2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxamide

C13H16N4O2 — CID 13250671

IUPAC2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxamide
SMILESCC(C)C1(C)N=C(c2ncccc2C(N)=O)NC1=O
InChIInChI=1S/C13H16N4O2/c1-7(2)13(3)12(19)16-11(17-13)9-8(10(14)18)5-4-6-15-9/h4-7H,1-3H3,(H2,14,18)(H,16,17,19)
InChIKeySFZJMAARHIOJQQ-UHFFFAOYSA-N
MW260.30 g/mol
LogP0.47
Rot. Bonds3

About 2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxamide

2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxamide (PubChem CID 13250671) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is 2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxamide
PubChem CID13250671
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC Name2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxamide
SMILESCC(C)C1(C)N=C(c2ncccc2C(N)=O)NC1=O
InChIInChI=1S/C13H16N4O2/c1-7(2)13(3)12(19)16-11(17-13)9-8(10(14)18)5-4-6-15-9/h4-7H,1-3H3,(H2,14,18)(H,16,17,19)
InChIKeySFZJMAARHIOJQQ-UHFFFAOYSA-N
XLogP0.47
TPSA97.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxamide?
The IUPAC name of 2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxamide (CID 13250671) is 2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxamide.
What is the SMILES notation for 2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxamide?
The canonical SMILES for 2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxamide is CC(C)C1(C)N=C(c2ncccc2C(N)=O)NC1=O.
What is the InChIKey of 2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxamide?
The InChIKey is SFZJMAARHIOJQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-7(2)13(3)12(19)16-11(17-13)9-8(10(14)18)5-4-6-15-9/h4-7H,1-3H3,(H2,14,18)(H,16,17,19).
What are the key properties of 2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxamide?
2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxamide has a molecular weight of 260.30 g/mol, XLogP of 0.47, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 13250671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).