2-amino-3-(1-methyl-2-oxo-3-pyridinyl)propanamide

C9H13N3O2 — CID 170632101

IUPAC2-amino-3-(1-methyl-2-oxo-3-pyridinyl)propanamide
SMILESCn1cccc(CC(N)C(N)=O)c1=O
InChIInChI=1S/C9H13N3O2/c1-12-4-2-3-6(9(12)14)5-7(10)8(11)13/h2-4,7H,5,10H2,1H3,(H2,11,13)
InChIKeyYFESFQSVIWHNOB-UHFFFAOYSA-N
MW195.22 g/mol
LogP-1.26
Rot. Bonds3

About 2-amino-3-(1-methyl-2-oxo-3-pyridinyl)propanamide

2-amino-3-(1-methyl-2-oxo-3-pyridinyl)propanamide (PubChem CID 170632101) has the molecular formula C9H13N3O2 and a molecular weight of 195.22 g/mol. Its IUPAC name is 2-amino-3-(1-methyl-2-oxo-3-pyridinyl)propanamide.

Molecular Properties

Compound Name2-amino-3-(1-methyl-2-oxo-3-pyridinyl)propanamide
PubChem CID170632101
Molecular FormulaC9H13N3O2
Molecular Weight195.22 g/mol
Exact Mass195.10
IUPAC Name2-amino-3-(1-methyl-2-oxo-3-pyridinyl)propanamide
SMILESCn1cccc(CC(N)C(N)=O)c1=O
InChIInChI=1S/C9H13N3O2/c1-12-4-2-3-6(9(12)14)5-7(10)8(11)13/h2-4,7H,5,10H2,1H3,(H2,11,13)
InChIKeyYFESFQSVIWHNOB-UHFFFAOYSA-N
XLogP-1.26
TPSA91.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 5-1.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-3-(1-methyl-2-oxo-3-pyridinyl)propanamide?
The IUPAC name of 2-amino-3-(1-methyl-2-oxo-3-pyridinyl)propanamide (CID 170632101) is 2-amino-3-(1-methyl-2-oxo-3-pyridinyl)propanamide.
What is the SMILES notation for 2-amino-3-(1-methyl-2-oxo-3-pyridinyl)propanamide?
The canonical SMILES for 2-amino-3-(1-methyl-2-oxo-3-pyridinyl)propanamide is Cn1cccc(CC(N)C(N)=O)c1=O.
What is the InChIKey of 2-amino-3-(1-methyl-2-oxo-3-pyridinyl)propanamide?
The InChIKey is YFESFQSVIWHNOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2/c1-12-4-2-3-6(9(12)14)5-7(10)8(11)13/h2-4,7H,5,10H2,1H3,(H2,11,13).
What are the key properties of 2-amino-3-(1-methyl-2-oxo-3-pyridinyl)propanamide?
2-amino-3-(1-methyl-2-oxo-3-pyridinyl)propanamide has a molecular weight of 195.22 g/mol, XLogP of -1.26, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-(1-methyl-2-oxo-3-pyridinyl)propanamide is sourced from PubChem (CID 170632101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).