6-ethyl-5-methyl-1-(3-methylbutyl)-2-oxopyridine-3-carboxamide

C14H22N2O2 — CID 71179285

IUPAC6-ethyl-5-methyl-1-(3-methylbutyl)-2-oxopyridine-3-carboxamide
SMILESCCc1c(C)cc(C(N)=O)c(=O)n1CCC(C)C
InChIInChI=1S/C14H22N2O2/c1-5-12-10(4)8-11(13(15)17)14(18)16(12)7-6-9(2)3/h8-9H,5-7H2,1-4H3,(H2,15,17)
InChIKeyZYHNQEGYBKAWHG-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.86
Rot. Bonds5

About 6-ethyl-5-methyl-1-(3-methylbutyl)-2-oxopyridine-3-carboxamide

6-ethyl-5-methyl-1-(3-methylbutyl)-2-oxopyridine-3-carboxamide (PubChem CID 71179285) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 6-ethyl-5-methyl-1-(3-methylbutyl)-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name6-ethyl-5-methyl-1-(3-methylbutyl)-2-oxopyridine-3-carboxamide
PubChem CID71179285
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name6-ethyl-5-methyl-1-(3-methylbutyl)-2-oxopyridine-3-carboxamide
SMILESCCc1c(C)cc(C(N)=O)c(=O)n1CCC(C)C
InChIInChI=1S/C14H22N2O2/c1-5-12-10(4)8-11(13(15)17)14(18)16(12)7-6-9(2)3/h8-9H,5-7H2,1-4H3,(H2,15,17)
InChIKeyZYHNQEGYBKAWHG-UHFFFAOYSA-N
XLogP1.86
TPSA65.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-5-methyl-1-(3-methylbutyl)-2-oxopyridine-3-carboxamide?
The IUPAC name of 6-ethyl-5-methyl-1-(3-methylbutyl)-2-oxopyridine-3-carboxamide (CID 71179285) is 6-ethyl-5-methyl-1-(3-methylbutyl)-2-oxopyridine-3-carboxamide.
What is the SMILES notation for 6-ethyl-5-methyl-1-(3-methylbutyl)-2-oxopyridine-3-carboxamide?
The canonical SMILES for 6-ethyl-5-methyl-1-(3-methylbutyl)-2-oxopyridine-3-carboxamide is CCc1c(C)cc(C(N)=O)c(=O)n1CCC(C)C.
What is the InChIKey of 6-ethyl-5-methyl-1-(3-methylbutyl)-2-oxopyridine-3-carboxamide?
The InChIKey is ZYHNQEGYBKAWHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-5-12-10(4)8-11(13(15)17)14(18)16(12)7-6-9(2)3/h8-9H,5-7H2,1-4H3,(H2,15,17).
What are the key properties of 6-ethyl-5-methyl-1-(3-methylbutyl)-2-oxopyridine-3-carboxamide?
6-ethyl-5-methyl-1-(3-methylbutyl)-2-oxopyridine-3-carboxamide has a molecular weight of 250.34 g/mol, XLogP of 1.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-5-methyl-1-(3-methylbutyl)-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 71179285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).