N-methyl-2-(pyridin-2-ylamino)propanamide

C9H13N3O — CID 61464552

IUPACN-methyl-2-(pyridin-2-ylamino)propanamide
SMILESCNC(=O)C(C)Nc1ccccn1
InChIInChI=1S/C9H13N3O/c1-7(9(13)10-2)12-8-5-3-4-6-11-8/h3-7H,1-2H3,(H,10,13)(H,11,12)
InChIKeyQLYPLYQYJHBUEK-UHFFFAOYSA-N
MW179.22 g/mol
LogP0.63
Rot. Bonds3

About N-methyl-2-(pyridin-2-ylamino)propanamide

N-methyl-2-(pyridin-2-ylamino)propanamide (PubChem CID 61464552) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is N-methyl-2-(pyridin-2-ylamino)propanamide.

Molecular Properties

Compound NameN-methyl-2-(pyridin-2-ylamino)propanamide
PubChem CID61464552
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC NameN-methyl-2-(pyridin-2-ylamino)propanamide
SMILESCNC(=O)C(C)Nc1ccccn1
InChIInChI=1S/C9H13N3O/c1-7(9(13)10-2)12-8-5-3-4-6-11-8/h3-7H,1-2H3,(H,10,13)(H,11,12)
InChIKeyQLYPLYQYJHBUEK-UHFFFAOYSA-N
XLogP0.63
TPSA54.02 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 ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(pyridin-2-ylamino)propanoic acid;hydrate;dihydrochloride
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N-methyl-2-[(5-methyl-2-pyridinyl)amino]propanamide
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1-(pyridin-2-ylamino)ethanol
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N-methyl-2-[[(1R)-1-pyridin-2-ylethyl]amino]propanamide
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1-piperidin-1-yl-2-(pyridin-2-ylamino)propan-1-one
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2-[(4-carbamothioyl-2-pyridinyl)amino]-N-methylpropanamide
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2-chloro-N-pyridin-2-ylpropanamide
CID 16789014
(2R,3S)-2-amino-3-(pyridin-2-ylamino)butanoic acid
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(2R)-2-amino-3-pyridin-2-ylpropanoic acid;(2S)-2-(pyridin-2-ylamino)propanoic acid
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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(pyridin-2-ylamino)propanamide?
The IUPAC name of N-methyl-2-(pyridin-2-ylamino)propanamide (CID 61464552) is N-methyl-2-(pyridin-2-ylamino)propanamide.
What is the SMILES notation for N-methyl-2-(pyridin-2-ylamino)propanamide?
The canonical SMILES for N-methyl-2-(pyridin-2-ylamino)propanamide is CNC(=O)C(C)Nc1ccccn1.
What is the InChIKey of N-methyl-2-(pyridin-2-ylamino)propanamide?
The InChIKey is QLYPLYQYJHBUEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c1-7(9(13)10-2)12-8-5-3-4-6-11-8/h3-7H,1-2H3,(H,10,13)(H,11,12).
What are the key properties of N-methyl-2-(pyridin-2-ylamino)propanamide?
N-methyl-2-(pyridin-2-ylamino)propanamide has a molecular weight of 179.22 g/mol, XLogP of 0.63, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(pyridin-2-ylamino)propanamide is sourced from PubChem (CID 61464552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).