Home Aminos [1-(3-aminobenzoyl)piperidin-3-yl]methanol

[1-(3-aminobenzoyl)piperidin-3-yl]methanol

CAS No.:
1154252-59-1
Catalog Number:
AG01AADE
Molecular Formula:
C13H18N2O2
Molecular Weight:
234.2942
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Product Description
Catalog Number:
AG01AADE
Chemical Name:
[1-(3-aminobenzoyl)piperidin-3-yl]methanol
CAS Number:
1154252-59-1
Molecular Formula:
C13H18N2O2
Molecular Weight:
234.2942
MDL Number:
MFCD12079279
IUPAC Name:
(3-aminophenyl)-[3-(hydroxymethyl)piperidin-1-yl]methanone
InChI:
InChI=1S/C13H18N2O2/c14-12-5-1-4-11(7-12)13(17)15-6-2-3-10(8-15)9-16/h1,4-5,7,10,16H,2-3,6,8-9,14H2
InChI Key:
CIFLJOJPDJTRBY-UHFFFAOYSA-N
SMILES:
OCC1CCCN(C1)C(=O)c1cccc(c1)N
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.137g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
234.299g/mol
Monoisotopic Mass:
234.137g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties