3-amino-N-methyl-2-pyridin-3-ylpropanamide

C9H13N3O — CID 119030789

IUPAC3-amino-N-methyl-2-pyridin-3-ylpropanamide
SMILESCNC(=O)C(CN)c1cccnc1
InChIInChI=1S/C9H13N3O/c1-11-9(13)8(5-10)7-3-2-4-12-6-7/h2-4,6,8H,5,10H2,1H3,(H,11,13)
InChIKeyYMFRWOLUSVBJPD-UHFFFAOYSA-N
MW179.22 g/mol
LogP-0.13
Rot. Bonds3

About 3-amino-N-methyl-2-pyridin-3-ylpropanamide

3-amino-N-methyl-2-pyridin-3-ylpropanamide (PubChem CID 119030789) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is 3-amino-N-methyl-2-pyridin-3-ylpropanamide.

Molecular Properties

Compound Name3-amino-N-methyl-2-pyridin-3-ylpropanamide
PubChem CID119030789
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC Name3-amino-N-methyl-2-pyridin-3-ylpropanamide
SMILESCNC(=O)C(CN)c1cccnc1
InChIInChI=1S/C9H13N3O/c1-11-9(13)8(5-10)7-3-2-4-12-6-7/h2-4,6,8H,5,10H2,1H3,(H,11,13)
InChIKeyYMFRWOLUSVBJPD-UHFFFAOYSA-N
XLogP-0.13
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl (2S)-3-amino-2-pyridin-3-ylpropanoate
CID 57242808
ethyl 3-amino-2-pyridin-3-ylpropanoate;dihydrochloride
CID 19697901
N-methyl-2-[[(1S)-1-pyridin-3-ylethyl]amino]propanamide
CID 81404603
6-[tert-butyl(dimethyl)silyl]oxy-N-methyl-2-pyridin-3-ylhexanamide
CID 10783116
4-methyl-2-pyridin-3-ylpentanamide
CID 68724697
3-[(2-amino-1-pyridin-3-ylethyl)-methylamino]-N-methylpropanamide
CID 106914569
2-(aminomethyl)-N-[(1R)-1-pyridin-3-ylethyl]butanamide
CID 81405062
2-pyridin-3-ylpropanehydrazide
CID 116843938
1-methyl-3-(1-pyridin-3-ylethyl)urea
CID 115576611
N-methyl-4-(1-pyridin-3-ylethylamino)benzamide
CID 43683661
N-methylpyridine-3-carboxamide chloride
CID 20976730
4-amino-3-methyl-N-[(1R)-1-pyridin-3-ylethyl]butanamide
CID 81404984

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-methyl-2-pyridin-3-ylpropanamide?
The IUPAC name of 3-amino-N-methyl-2-pyridin-3-ylpropanamide (CID 119030789) is 3-amino-N-methyl-2-pyridin-3-ylpropanamide.
What is the SMILES notation for 3-amino-N-methyl-2-pyridin-3-ylpropanamide?
The canonical SMILES for 3-amino-N-methyl-2-pyridin-3-ylpropanamide is CNC(=O)C(CN)c1cccnc1.
What is the InChIKey of 3-amino-N-methyl-2-pyridin-3-ylpropanamide?
The InChIKey is YMFRWOLUSVBJPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c1-11-9(13)8(5-10)7-3-2-4-12-6-7/h2-4,6,8H,5,10H2,1H3,(H,11,13).
What are the key properties of 3-amino-N-methyl-2-pyridin-3-ylpropanamide?
3-amino-N-methyl-2-pyridin-3-ylpropanamide has a molecular weight of 179.22 g/mol, XLogP of -0.13, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-methyl-2-pyridin-3-ylpropanamide is sourced from PubChem (CID 119030789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).