6-ethyl-N-[(2S)-heptan-2-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide

C16H26N2O2 — CID 125490976

IUPAC6-ethyl-N-[(2S)-heptan-2-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCCCCC[C@H](C)NC(=O)c1cc(C)c(CC)[nH]c1=O
InChIInChI=1S/C16H26N2O2/c1-5-7-8-9-12(4)17-15(19)13-10-11(3)14(6-2)18-16(13)20/h10,12H,5-9H2,1-4H3,(H,17,19)(H,18,20)/t12-/m0/s1
InChIKeyNOOOEWXHSKNHLK-LBPRGKRZSA-N
MW278.40 g/mol
LogP2.94
Rot. Bonds7

About 6-ethyl-N-[(2S)-heptan-2-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide

6-ethyl-N-[(2S)-heptan-2-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 125490976) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 6-ethyl-N-[(2S)-heptan-2-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name6-ethyl-N-[(2S)-heptan-2-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide
PubChem CID125490976
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name6-ethyl-N-[(2S)-heptan-2-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCCCCC[C@H](C)NC(=O)c1cc(C)c(CC)[nH]c1=O
InChIInChI=1S/C16H26N2O2/c1-5-7-8-9-12(4)17-15(19)13-10-11(3)14(6-2)18-16(13)20/h10,12H,5-9H2,1-4H3,(H,17,19)(H,18,20)/t12-/m0/s1
InChIKeyNOOOEWXHSKNHLK-LBPRGKRZSA-N
XLogP2.94
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 6-ethyl-N-[(2S)-heptan-2-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2S)-heptan-2-yl]-5-methyl-2-oxo-6-propyl-1H-pyridine-3-carboxamide
CID 125491124
5,6-dimethyl-N-[(2S)-octan-2-yl]-2-oxo-1H-pyridine-3-carboxamide
CID 125490337
6-ethyl-N-[(3S)-heptan-3-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 125490592
5-bromo-6-methyl-N-[(2R)-octan-2-yl]-2-oxo-1H-pyridine-3-carboxamide
CID 125490373
6-methyl-N-[(2R)-octan-2-yl]-2-oxo-5-propyl-1H-pyridine-3-carboxamide
CID 125490774
6-ethyl-5-iodo-2-oxo-N-[(2R)-pentan-2-yl]-1H-pyridine-3-carboxamide
CID 125491217
5-chloro-6-ethyl-2-oxo-N-[(2R)-pentan-2-yl]-1H-pyridine-3-carboxamide
CID 125490940
N-[(3S)-heptan-3-yl]-5-methyl-2-oxo-6-propyl-1H-pyridine-3-carboxamide
CID 125491426
5-bromo-6-ethyl-N-[(2R)-4-methylpentan-2-yl]-2-oxo-1H-pyridine-3-carboxamide
CID 125490531
4-hydroxy-2-methyl-N-octan-2-ylbenzamide
CID 103865158
N-(3-ethoxypropyl)-6-ethyl-5-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 125490909
2-fluoro-3-methyl-N-octan-2-ylbenzamide
CID 81480572

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-N-[(2S)-heptan-2-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 6-ethyl-N-[(2S)-heptan-2-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide (CID 125490976) is 6-ethyl-N-[(2S)-heptan-2-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 6-ethyl-N-[(2S)-heptan-2-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 6-ethyl-N-[(2S)-heptan-2-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide is CCCCC[C@H](C)NC(=O)c1cc(C)c(CC)[nH]c1=O.
What is the InChIKey of 6-ethyl-N-[(2S)-heptan-2-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is NOOOEWXHSKNHLK-LBPRGKRZSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-5-7-8-9-12(4)17-15(19)13-10-11(3)14(6-2)18-16(13)20/h10,12H,5-9H2,1-4H3,(H,17,19)(H,18,20)/t12-/m0/s1.
What are the key properties of 6-ethyl-N-[(2S)-heptan-2-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide?
6-ethyl-N-[(2S)-heptan-2-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 278.40 g/mol, XLogP of 2.94, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N-[(2S)-heptan-2-yl]-5-methyl-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 125490976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).