1-ethyl-N-[(1S,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide

C18H23N3O2 — CID 7619800

IUPAC1-ethyl-N-[(1S,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide
SMILESCCn1c(=O)c(C(=O)N[C@H]2CCCC[C@@H]2C)cc2cccnc21
InChIInChI=1S/C18H23N3O2/c1-3-21-16-13(8-6-10-19-16)11-14(18(21)23)17(22)20-15-9-5-4-7-12(15)2/h6,8,10-12,15H,3-5,7,9H2,1-2H3,(H,20,22)/t12-,15-/m0/s1
InChIKeyYEUVKPBOOWUELI-WFASDCNBSA-N
MW313.40 g/mol
LogP2.72
Rot. Bonds3

About 1-ethyl-N-[(1S,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide

1-ethyl-N-[(1S,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide (PubChem CID 7619800) has the molecular formula C18H23N3O2 and a molecular weight of 313.40 g/mol. Its IUPAC name is 1-ethyl-N-[(1S,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-[(1S,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide
PubChem CID7619800
Molecular FormulaC18H23N3O2
Molecular Weight313.40 g/mol
Exact Mass313.18
IUPAC Name1-ethyl-N-[(1S,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide
SMILESCCn1c(=O)c(C(=O)N[C@H]2CCCC[C@@H]2C)cc2cccnc21
InChIInChI=1S/C18H23N3O2/c1-3-21-16-13(8-6-10-19-16)11-14(18(21)23)17(22)20-15-9-5-4-7-12(15)2/h6,8,10-12,15H,3-5,7,9H2,1-2H3,(H,20,22)/t12-,15-/m0/s1
InChIKeyYEUVKPBOOWUELI-WFASDCNBSA-N
XLogP2.72
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619782
N-[(1R,2S)-2-methylcyclohexyl]-1-[(4-methylphenyl)methyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7620470
1-methyl-N-[(1R,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619418
1-[(4-fluorophenyl)methyl]-N-[(1S,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7620734
1-[(2-fluorophenyl)methyl]-N-[(1R,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7620975
1-[(2-fluorophenyl)methyl]-N-[(1R,2R)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7620974
2-[(1-ethyl-2-oxo-1,8-naphthyridine-3-carbonyl)amino]benzenethiolate
CID 135782783
N-(3,5-dimethylphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619925
1-[(4-chlorophenyl)methyl]-N-cycloheptyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7621189
N-(3,3-diphenylpropyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619829
1-ethyl-N-[(4-methylphenyl)methyl]-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619808
N-(3-acetylphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619897

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[(1S,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide?
The IUPAC name of 1-ethyl-N-[(1S,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide (CID 7619800) is 1-ethyl-N-[(1S,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for 1-ethyl-N-[(1S,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for 1-ethyl-N-[(1S,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide is CCn1c(=O)c(C(=O)N[C@H]2CCCC[C@@H]2C)cc2cccnc21.
What is the InChIKey of 1-ethyl-N-[(1S,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide?
The InChIKey is YEUVKPBOOWUELI-WFASDCNBSA-N. The full InChI is InChI=1S/C18H23N3O2/c1-3-21-16-13(8-6-10-19-16)11-14(18(21)23)17(22)20-15-9-5-4-7-12(15)2/h6,8,10-12,15H,3-5,7,9H2,1-2H3,(H,20,22)/t12-,15-/m0/s1.
What are the key properties of 1-ethyl-N-[(1S,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide?
1-ethyl-N-[(1S,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide has a molecular weight of 313.40 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[(1S,2S)-2-methylcyclohexyl]-2-oxo-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 7619800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).