1-butyl-6-ethyl-5-methyl-2-oxo-N-propan-2-ylpyridine-3-carboxamide

C16H26N2O2 — CID 59718739

IUPAC1-butyl-6-ethyl-5-methyl-2-oxo-N-propan-2-ylpyridine-3-carboxamide
SMILESCCCCn1c(CC)c(C)cc(C(=O)NC(C)C)c1=O
InChIInChI=1S/C16H26N2O2/c1-6-8-9-18-14(7-2)12(5)10-13(16(18)20)15(19)17-11(3)4/h10-11H,6-9H2,1-5H3,(H,17,19)
InChIKeyQWGZUHIRKUUBFT-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.66
Rot. Bonds6

About 1-butyl-6-ethyl-5-methyl-2-oxo-N-propan-2-ylpyridine-3-carboxamide

1-butyl-6-ethyl-5-methyl-2-oxo-N-propan-2-ylpyridine-3-carboxamide (PubChem CID 59718739) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 1-butyl-6-ethyl-5-methyl-2-oxo-N-propan-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name1-butyl-6-ethyl-5-methyl-2-oxo-N-propan-2-ylpyridine-3-carboxamide
PubChem CID59718739
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name1-butyl-6-ethyl-5-methyl-2-oxo-N-propan-2-ylpyridine-3-carboxamide
SMILESCCCCn1c(CC)c(C)cc(C(=O)NC(C)C)c1=O
InChIInChI=1S/C16H26N2O2/c1-6-8-9-18-14(7-2)12(5)10-13(16(18)20)15(19)17-11(3)4/h10-11H,6-9H2,1-5H3,(H,17,19)
InChIKeyQWGZUHIRKUUBFT-UHFFFAOYSA-N
XLogP2.66
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-butyl-6-ethyl-5-methyl-2-oxo-N-propan-2-ylpyridine-3-carboxamide?
The IUPAC name of 1-butyl-6-ethyl-5-methyl-2-oxo-N-propan-2-ylpyridine-3-carboxamide (CID 59718739) is 1-butyl-6-ethyl-5-methyl-2-oxo-N-propan-2-ylpyridine-3-carboxamide.
What is the SMILES notation for 1-butyl-6-ethyl-5-methyl-2-oxo-N-propan-2-ylpyridine-3-carboxamide?
The canonical SMILES for 1-butyl-6-ethyl-5-methyl-2-oxo-N-propan-2-ylpyridine-3-carboxamide is CCCCn1c(CC)c(C)cc(C(=O)NC(C)C)c1=O.
What is the InChIKey of 1-butyl-6-ethyl-5-methyl-2-oxo-N-propan-2-ylpyridine-3-carboxamide?
The InChIKey is QWGZUHIRKUUBFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-6-8-9-18-14(7-2)12(5)10-13(16(18)20)15(19)17-11(3)4/h10-11H,6-9H2,1-5H3,(H,17,19).
What are the key properties of 1-butyl-6-ethyl-5-methyl-2-oxo-N-propan-2-ylpyridine-3-carboxamide?
1-butyl-6-ethyl-5-methyl-2-oxo-N-propan-2-ylpyridine-3-carboxamide has a molecular weight of 278.40 g/mol, XLogP of 2.66, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-6-ethyl-5-methyl-2-oxo-N-propan-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 59718739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).