(2S)-1-benzyl-N-cyclopentyl-4-oxo-2-[(E)-2-phenylethenyl]azetidine-2-carboxamide

C24H26N2O2 — CID 7709089

IUPAC(2S)-1-benzyl-N-cyclopentyl-4-oxo-2-[(E)-2-phenylethenyl]azetidine-2-carboxamide
SMILESO=C1C[C@](/C=C/c2ccccc2)(C(=O)NC2CCCC2)N1Cc1ccccc1
InChIInChI=1S/C24H26N2O2/c27-22-17-24(16-15-19-9-3-1-4-10-19,23(28)25-21-13-7-8-14-21)26(22)18-20-11-5-2-6-12-20/h1-6,9-12,15-16,21H,7-8,13-14,17-18H2,(H,25,28)/b16-15+/t24-/m1/s1
InChIKeyIGMLYZRRNFOPGK-RFAWQRTRSA-N
MW374.48 g/mol
LogP3.93
Rot. Bonds6

About (2S)-1-benzyl-N-cyclopentyl-4-oxo-2-[(E)-2-phenylethenyl]azetidine-2-carboxamide

(2S)-1-benzyl-N-cyclopentyl-4-oxo-2-[(E)-2-phenylethenyl]azetidine-2-carboxamide (PubChem CID 7709089) has the molecular formula C24H26N2O2 and a molecular weight of 374.48 g/mol. Its IUPAC name is (2S)-1-benzyl-N-cyclopentyl-4-oxo-2-[(E)-2-phenylethenyl]azetidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-1-benzyl-N-cyclopentyl-4-oxo-2-[(E)-2-phenylethenyl]azetidine-2-carboxamide
PubChem CID7709089
Molecular FormulaC24H26N2O2
Molecular Weight374.48 g/mol
Exact Mass374.20
IUPAC Name(2S)-1-benzyl-N-cyclopentyl-4-oxo-2-[(E)-2-phenylethenyl]azetidine-2-carboxamide
SMILESO=C1C[C@](/C=C/c2ccccc2)(C(=O)NC2CCCC2)N1Cc1ccccc1
InChIInChI=1S/C24H26N2O2/c27-22-17-24(16-15-19-9-3-1-4-10-19,23(28)25-21-13-7-8-14-21)26(22)18-20-11-5-2-6-12-20/h1-6,9-12,15-16,21H,7-8,13-14,17-18H2,(H,25,28)/b16-15+/t24-/m1/s1
InChIKeyIGMLYZRRNFOPGK-RFAWQRTRSA-N
XLogP3.93
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.48
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-cyclohexyl-4-oxo-2-[(E)-2-phenylethenyl]-1-(4-propan-2-ylphenyl)azetidine-2-carboxamide
CID 1468011
N-cyclohexyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-2-(2-phenylethenyl)azetidine-2-carboxamide
CID 3153762
(3S)-2-benzyl-N-cyclohexyl-3-methyl-1-oxo-4H-isoquinoline-3-carboxamide
CID 92701404
(5aR,9aS)-5-benzyl-N-cyclohexyl-4-oxo-3,6,7,8,9,9a-hexahydro-2H-benzo[b][1,4]thiazepine-5a-carboxamide
CID 9497472
4-benzyl-N-cyclohexyl-3-methyl-5-oxo-1,4-thiazepane-3-carboxamide
CID 11111185
N-cyclohexyl-1-(4-ethylphenyl)-2-[2-(2-methoxyphenyl)ethenyl]-4-oxoazetidine-2-carboxamide
CID 3219563
1-amino-N-(1-benzylpiperidin-4-yl)cyclopropane-1-carboxamide;dihydrochloride
CID 119827542
(2R)-N-cyclohexyl-1-(4-fluorophenyl)-2-[(E)-2-(2-methoxyphenyl)ethenyl]-4-oxoazetidine-2-carboxamide
CID 1469478
(E)-N-cycloheptyl-3-phenylprop-2-enamide
CID 6027758
2-benzyl-N-cyclohexyl-3-methyl-1,4-dioxopyrazino[1,2-a]indole-3-carboxamide
CID 50767868
6-benzyl-N-cyclopentyl-7-methyl-5-oxopyrido[3,2-d][2]benzazepine-7-carboxamide
CID 71161683
N-cyclopentyl-2-phenylacetamide;hydrochloride
CID 69292876

Frequently Asked Questions

What is the IUPAC name of (2S)-1-benzyl-N-cyclopentyl-4-oxo-2-[(E)-2-phenylethenyl]azetidine-2-carboxamide?
The IUPAC name of (2S)-1-benzyl-N-cyclopentyl-4-oxo-2-[(E)-2-phenylethenyl]azetidine-2-carboxamide (CID 7709089) is (2S)-1-benzyl-N-cyclopentyl-4-oxo-2-[(E)-2-phenylethenyl]azetidine-2-carboxamide.
What is the SMILES notation for (2S)-1-benzyl-N-cyclopentyl-4-oxo-2-[(E)-2-phenylethenyl]azetidine-2-carboxamide?
The canonical SMILES for (2S)-1-benzyl-N-cyclopentyl-4-oxo-2-[(E)-2-phenylethenyl]azetidine-2-carboxamide is O=C1C[C@](/C=C/c2ccccc2)(C(=O)NC2CCCC2)N1Cc1ccccc1.
What is the InChIKey of (2S)-1-benzyl-N-cyclopentyl-4-oxo-2-[(E)-2-phenylethenyl]azetidine-2-carboxamide?
The InChIKey is IGMLYZRRNFOPGK-RFAWQRTRSA-N. The full InChI is InChI=1S/C24H26N2O2/c27-22-17-24(16-15-19-9-3-1-4-10-19,23(28)25-21-13-7-8-14-21)26(22)18-20-11-5-2-6-12-20/h1-6,9-12,15-16,21H,7-8,13-14,17-18H2,(H,25,28)/b16-15+/t24-/m1/s1.
What are the key properties of (2S)-1-benzyl-N-cyclopentyl-4-oxo-2-[(E)-2-phenylethenyl]azetidine-2-carboxamide?
(2S)-1-benzyl-N-cyclopentyl-4-oxo-2-[(E)-2-phenylethenyl]azetidine-2-carboxamide has a molecular weight of 374.48 g/mol, XLogP of 3.93, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-benzyl-N-cyclopentyl-4-oxo-2-[(E)-2-phenylethenyl]azetidine-2-carboxamide is sourced from PubChem (CID 7709089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).