Home Aminos 4-methyl-3-{[(1-methylpiperidin-4-yl)methyl]amino}benzoic acid hydrochloride

4-methyl-3-{[(1-methylpiperidin-4-yl)methyl]amino}benzoic acid hydrochloride

CAS No.:
2060037-90-1
Catalog Number:
AG01BRPF
Molecular Formula:
C15H23ClN2O2
Molecular Weight:
298.8083
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Product Description
Catalog Number:
AG01BRPF
Chemical Name:
4-methyl-3-{[(1-methylpiperidin-4-yl)methyl]amino}benzoic acid hydrochloride
CAS Number:
2060037-90-1
Molecular Formula:
C15H23ClN2O2
Molecular Weight:
298.8083
MDL Number:
MFCD30535849
IUPAC Name:
4-methyl-3-[(1-methylpiperidin-4-yl)methylamino]benzoic acid;hydrochloride
InChI:
InChI=1S/C15H22N2O2.ClH/c1-11-3-4-13(15(18)19)9-14(11)16-10-12-5-7-17(2)8-6-12;/h3-4,9,12,16H,5-8,10H2,1-2H3,(H,18,19);1H
InChI Key:
OHPHIPUAHDXJIR-UHFFFAOYSA-N
SMILES:
CN1CCC(CC1)CNc1cc(ccc1C)C(=O)O.Cl
Properties
Complexity:
301  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.145g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
298.811g/mol
Monoisotopic Mass:
298.145g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties