Home Aminos 3-amino-2-[(1-methyl-1H-pyrazol-4-yl)methyl]propanamide dihydrochloride

3-amino-2-[(1-methyl-1H-pyrazol-4-yl)methyl]propanamide dihydrochloride

CAS No.:
1423029-20-2
Catalog Number:
AG01A2SN
Molecular Formula:
C8H16Cl2N4O
Molecular Weight:
255.1448
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Product Description
Catalog Number:
AG01A2SN
Chemical Name:
3-amino-2-[(1-methyl-1H-pyrazol-4-yl)methyl]propanamide dihydrochloride
CAS Number:
1423029-20-2
Molecular Formula:
C8H16Cl2N4O
Molecular Weight:
255.1448
MDL Number:
MFCD22578730
IUPAC Name:
2-(aminomethyl)-3-(1-methylpyrazol-4-yl)propanamide;dihydrochloride
InChI:
InChI=1S/C8H14N4O.2ClH/c1-12-5-6(4-11-12)2-7(3-9)8(10)13;;/h4-5,7H,2-3,9H2,1H3,(H2,10,13);2*1H
InChI Key:
GTNUGJODJUCKDC-UHFFFAOYSA-N
SMILES:
NCC(C(=O)N)Cc1cnn(c1)C.Cl.Cl
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.07g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
255.143g/mol
Monoisotopic Mass:
254.07g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
86.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties