2-ethyl-6-methyl-4-oxo-N-propan-2-yl-1H-pyridine-3-carboxamide

C12H18N2O2 — CID 57122485

IUPAC2-ethyl-6-methyl-4-oxo-N-propan-2-yl-1H-pyridine-3-carboxamide
SMILESCCc1[nH]c(C)cc(=O)c1C(=O)NC(C)C
InChIInChI=1S/C12H18N2O2/c1-5-9-11(12(16)13-7(2)3)10(15)6-8(4)14-9/h6-7H,5H2,1-4H3,(H,13,16)(H,14,15)
InChIKeyOLRRNILAGXVBFZ-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.38
Rot. Bonds3

About 2-ethyl-6-methyl-4-oxo-N-propan-2-yl-1H-pyridine-3-carboxamide

2-ethyl-6-methyl-4-oxo-N-propan-2-yl-1H-pyridine-3-carboxamide (PubChem CID 57122485) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-ethyl-6-methyl-4-oxo-N-propan-2-yl-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name2-ethyl-6-methyl-4-oxo-N-propan-2-yl-1H-pyridine-3-carboxamide
PubChem CID57122485
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name2-ethyl-6-methyl-4-oxo-N-propan-2-yl-1H-pyridine-3-carboxamide
SMILESCCc1[nH]c(C)cc(=O)c1C(=O)NC(C)C
InChIInChI=1S/C12H18N2O2/c1-5-9-11(12(16)13-7(2)3)10(15)6-8(4)14-9/h6-7H,5H2,1-4H3,(H,13,16)(H,14,15)
InChIKeyOLRRNILAGXVBFZ-UHFFFAOYSA-N
XLogP1.38
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-methyl-4-oxo-N-propan-2-yl-1H-pyridine-3-carboxamide?
The IUPAC name of 2-ethyl-6-methyl-4-oxo-N-propan-2-yl-1H-pyridine-3-carboxamide (CID 57122485) is 2-ethyl-6-methyl-4-oxo-N-propan-2-yl-1H-pyridine-3-carboxamide.
What is the SMILES notation for 2-ethyl-6-methyl-4-oxo-N-propan-2-yl-1H-pyridine-3-carboxamide?
The canonical SMILES for 2-ethyl-6-methyl-4-oxo-N-propan-2-yl-1H-pyridine-3-carboxamide is CCc1[nH]c(C)cc(=O)c1C(=O)NC(C)C.
What is the InChIKey of 2-ethyl-6-methyl-4-oxo-N-propan-2-yl-1H-pyridine-3-carboxamide?
The InChIKey is OLRRNILAGXVBFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-5-9-11(12(16)13-7(2)3)10(15)6-8(4)14-9/h6-7H,5H2,1-4H3,(H,13,16)(H,14,15).
What are the key properties of 2-ethyl-6-methyl-4-oxo-N-propan-2-yl-1H-pyridine-3-carboxamide?
2-ethyl-6-methyl-4-oxo-N-propan-2-yl-1H-pyridine-3-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 1.38, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-methyl-4-oxo-N-propan-2-yl-1H-pyridine-3-carboxamide is sourced from PubChem (CID 57122485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).