N-(4-ethyl-1H-pyrazol-5-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide

C12H14N4O2 — CID 103772025

IUPACN-(4-ethyl-1H-pyrazol-5-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
SMILESCCc1cn[nH]c1NC(=O)c1c[nH]c(C)cc1=O
InChIInChI=1S/C12H14N4O2/c1-3-8-5-14-16-11(8)15-12(18)9-6-13-7(2)4-10(9)17/h4-6H,3H2,1-2H3,(H,13,17)(H2,14,15,16,18)
InChIKeyPVFFLOXNWWZEFY-UHFFFAOYSA-N
MW246.27 g/mol
LogP1.22
Rot. Bonds3

About N-(4-ethyl-1H-pyrazol-5-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide

N-(4-ethyl-1H-pyrazol-5-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide (PubChem CID 103772025) has the molecular formula C12H14N4O2 and a molecular weight of 246.27 g/mol. Its IUPAC name is N-(4-ethyl-1H-pyrazol-5-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-ethyl-1H-pyrazol-5-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
PubChem CID103772025
Molecular FormulaC12H14N4O2
Molecular Weight246.27 g/mol
Exact Mass246.11
IUPAC NameN-(4-ethyl-1H-pyrazol-5-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
SMILESCCc1cn[nH]c1NC(=O)c1c[nH]c(C)cc1=O
InChIInChI=1S/C12H14N4O2/c1-3-8-5-14-16-11(8)15-12(18)9-6-13-7(2)4-10(9)17/h4-6H,3H2,1-2H3,(H,13,17)(H2,14,15,16,18)
InChIKeyPVFFLOXNWWZEFY-UHFFFAOYSA-N
XLogP1.22
TPSA90.64 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 51.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-1H-pyrazol-5-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(4-ethyl-1H-pyrazol-5-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide (CID 103772025) is N-(4-ethyl-1H-pyrazol-5-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(4-ethyl-1H-pyrazol-5-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(4-ethyl-1H-pyrazol-5-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide is CCc1cn[nH]c1NC(=O)c1c[nH]c(C)cc1=O.
What is the InChIKey of N-(4-ethyl-1H-pyrazol-5-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
The InChIKey is PVFFLOXNWWZEFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O2/c1-3-8-5-14-16-11(8)15-12(18)9-6-13-7(2)4-10(9)17/h4-6H,3H2,1-2H3,(H,13,17)(H2,14,15,16,18).
What are the key properties of N-(4-ethyl-1H-pyrazol-5-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
N-(4-ethyl-1H-pyrazol-5-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide has a molecular weight of 246.27 g/mol, XLogP of 1.22, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-1H-pyrazol-5-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 103772025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).