3-methyl-2-(propanoylamino)pyridine-4-carboxamide

C10H13N3O2 — CID 141332115

IUPAC3-methyl-2-(propanoylamino)pyridine-4-carboxamide
SMILESCCC(=O)Nc1nccc(C(N)=O)c1C
InChIInChI=1S/C10H13N3O2/c1-3-8(14)13-10-6(2)7(9(11)15)4-5-12-10/h4-5H,3H2,1-2H3,(H2,11,15)(H,12,13,14)
InChIKeyVIGHZVZAFSNTET-UHFFFAOYSA-N
MW207.23 g/mol
LogP0.84
Rot. Bonds3

About 3-methyl-2-(propanoylamino)pyridine-4-carboxamide

3-methyl-2-(propanoylamino)pyridine-4-carboxamide (PubChem CID 141332115) has the molecular formula C10H13N3O2 and a molecular weight of 207.23 g/mol. Its IUPAC name is 3-methyl-2-(propanoylamino)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-methyl-2-(propanoylamino)pyridine-4-carboxamide
PubChem CID141332115
Molecular FormulaC10H13N3O2
Molecular Weight207.23 g/mol
Exact Mass207.10
IUPAC Name3-methyl-2-(propanoylamino)pyridine-4-carboxamide
SMILESCCC(=O)Nc1nccc(C(N)=O)c1C
InChIInChI=1S/C10H13N3O2/c1-3-8(14)13-10-6(2)7(9(11)15)4-5-12-10/h4-5H,3H2,1-2H3,(H2,11,15)(H,12,13,14)
InChIKeyVIGHZVZAFSNTET-UHFFFAOYSA-N
XLogP0.84
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-(propanoylamino)pyridine-4-carboxamide?
The IUPAC name of 3-methyl-2-(propanoylamino)pyridine-4-carboxamide (CID 141332115) is 3-methyl-2-(propanoylamino)pyridine-4-carboxamide.
What is the SMILES notation for 3-methyl-2-(propanoylamino)pyridine-4-carboxamide?
The canonical SMILES for 3-methyl-2-(propanoylamino)pyridine-4-carboxamide is CCC(=O)Nc1nccc(C(N)=O)c1C.
What is the InChIKey of 3-methyl-2-(propanoylamino)pyridine-4-carboxamide?
The InChIKey is VIGHZVZAFSNTET-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2/c1-3-8(14)13-10-6(2)7(9(11)15)4-5-12-10/h4-5H,3H2,1-2H3,(H2,11,15)(H,12,13,14).
What are the key properties of 3-methyl-2-(propanoylamino)pyridine-4-carboxamide?
3-methyl-2-(propanoylamino)pyridine-4-carboxamide has a molecular weight of 207.23 g/mol, XLogP of 0.84, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-(propanoylamino)pyridine-4-carboxamide is sourced from PubChem (CID 141332115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).