1-ethyl-N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-2-oxopyridine-4-carboxamide

C20H23FN2O2 — CID 118762484

IUPAC1-ethyl-N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-2-oxopyridine-4-carboxamide
SMILESCCn1ccc(C(=O)N[C@H]2CCC[C@H]2Cc2ccc(F)cc2)cc1=O
InChIInChI=1S/C20H23FN2O2/c1-2-23-11-10-16(13-19(23)24)20(25)22-18-5-3-4-15(18)12-14-6-8-17(21)9-7-14/h6-11,13,15,18H,2-5,12H2,1H3,(H,22,25)/t15-,18-/m0/s1
InChIKeyDHPRIXUMFITDKJ-YJBOKZPZSA-N
MW342.41 g/mol
LogP3.15
Rot. Bonds5

About 1-ethyl-N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-2-oxopyridine-4-carboxamide

1-ethyl-N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-2-oxopyridine-4-carboxamide (PubChem CID 118762484) has the molecular formula C20H23FN2O2 and a molecular weight of 342.41 g/mol. Its IUPAC name is 1-ethyl-N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-2-oxopyridine-4-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-2-oxopyridine-4-carboxamide
PubChem CID118762484
Molecular FormulaC20H23FN2O2
Molecular Weight342.41 g/mol
Exact Mass342.17
IUPAC Name1-ethyl-N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-2-oxopyridine-4-carboxamide
SMILESCCn1ccc(C(=O)N[C@H]2CCC[C@H]2Cc2ccc(F)cc2)cc1=O
InChIInChI=1S/C20H23FN2O2/c1-2-23-11-10-16(13-19(23)24)20(25)22-18-5-3-4-15(18)12-14-6-8-17(21)9-7-14/h6-11,13,15,18H,2-5,12H2,1H3,(H,22,25)/t15-,18-/m0/s1
InChIKeyDHPRIXUMFITDKJ-YJBOKZPZSA-N
XLogP3.15
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.41
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-6-methyl-4-oxopyran-2-carboxamide
CID 90648014
N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide
CID 118769991
N-[2-(chloromethyl)cyclopentyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 106365913
4-chloro-N-[2-[(4-fluorophenyl)methyl]cyclopentyl]-1,3-dimethylpyrazole-5-carboxamide
CID 156607773
2-amino-N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-4-methyl-1,3-thiazole-5-carboxamide
CID 118773357
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]acetamide
CID 90653375
N-[2-[(dimethylamino)methyl]cyclohexyl]-4-fluorobenzamide
CID 110279233
1-ethyl-2-oxo-N-[(3S,4S)-4-(quinolin-4-ylmethyl)oxolan-3-yl]pyridine-4-carboxamide
CID 135098213
1-ethyl-N-[2-(hydroxymethyl)cyclohexyl]pyrrole-2-carboxamide
CID 114179190
N-[2-(chloromethyl)cyclohexyl]-4-fluorobenzamide
CID 114179591
4-(aminomethyl)-N-(2-benzylcyclopentyl)benzamide;hydrochloride
CID 119329447
N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-4-(tetrazol-1-yl)butanamide
CID 118765556

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-2-oxopyridine-4-carboxamide?
The IUPAC name of 1-ethyl-N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-2-oxopyridine-4-carboxamide (CID 118762484) is 1-ethyl-N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-2-oxopyridine-4-carboxamide.
What is the SMILES notation for 1-ethyl-N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-2-oxopyridine-4-carboxamide?
The canonical SMILES for 1-ethyl-N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-2-oxopyridine-4-carboxamide is CCn1ccc(C(=O)N[C@H]2CCC[C@H]2Cc2ccc(F)cc2)cc1=O.
What is the InChIKey of 1-ethyl-N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-2-oxopyridine-4-carboxamide?
The InChIKey is DHPRIXUMFITDKJ-YJBOKZPZSA-N. The full InChI is InChI=1S/C20H23FN2O2/c1-2-23-11-10-16(13-19(23)24)20(25)22-18-5-3-4-15(18)12-14-6-8-17(21)9-7-14/h6-11,13,15,18H,2-5,12H2,1H3,(H,22,25)/t15-,18-/m0/s1.
What are the key properties of 1-ethyl-N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-2-oxopyridine-4-carboxamide?
1-ethyl-N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-2-oxopyridine-4-carboxamide has a molecular weight of 342.41 g/mol, XLogP of 3.15, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[(1S,2S)-2-[(4-fluorophenyl)methyl]cyclopentyl]-2-oxopyridine-4-carboxamide is sourced from PubChem (CID 118762484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).