(3R,4S)-4-(4-methoxyphenyl)-1-phenyl-3-(3-pyridin-3-ylpropyl)azetidin-2-one

C24H24N2O2 — CID 15481172

IUPAC(3R,4S)-4-(4-methoxyphenyl)-1-phenyl-3-(3-pyridin-3-ylpropyl)azetidin-2-one
SMILESCOc1ccc([C@@H]2[C@@H](CCCc3cccnc3)C(=O)N2c2ccccc2)cc1
InChIInChI=1S/C24H24N2O2/c1-28-21-14-12-19(13-15-21)23-22(11-5-7-18-8-6-16-25-17-18)24(27)26(23)20-9-3-2-4-10-20/h2-4,6,8-10,12-17,22-23H,5,7,11H2,1H3/t22-,23-/m1/s1
InChIKeyFSJVGFSWFAWCEC-DHIUTWEWSA-N
MW372.47 g/mol
LogP4.82
Rot. Bonds7

About (3R,4S)-4-(4-methoxyphenyl)-1-phenyl-3-(3-pyridin-3-ylpropyl)azetidin-2-one

(3R,4S)-4-(4-methoxyphenyl)-1-phenyl-3-(3-pyridin-3-ylpropyl)azetidin-2-one (PubChem CID 15481172) has the molecular formula C24H24N2O2 and a molecular weight of 372.47 g/mol. Its IUPAC name is (3R,4S)-4-(4-methoxyphenyl)-1-phenyl-3-(3-pyridin-3-ylpropyl)azetidin-2-one.

Molecular Properties

Compound Name(3R,4S)-4-(4-methoxyphenyl)-1-phenyl-3-(3-pyridin-3-ylpropyl)azetidin-2-one
PubChem CID15481172
Molecular FormulaC24H24N2O2
Molecular Weight372.47 g/mol
Exact Mass372.18
IUPAC Name(3R,4S)-4-(4-methoxyphenyl)-1-phenyl-3-(3-pyridin-3-ylpropyl)azetidin-2-one
SMILESCOc1ccc([C@@H]2[C@@H](CCCc3cccnc3)C(=O)N2c2ccccc2)cc1
InChIInChI=1S/C24H24N2O2/c1-28-21-14-12-19(13-15-21)23-22(11-5-7-18-8-6-16-25-17-18)24(27)26(23)20-9-3-2-4-10-20/h2-4,6,8-10,12-17,22-23H,5,7,11H2,1H3/t22-,23-/m1/s1
InChIKeyFSJVGFSWFAWCEC-DHIUTWEWSA-N
XLogP4.82
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (3R,4S)-4-(4-methoxyphenyl)-1-phenyl-3-(3-pyridin-3-ylpropyl)azetidin-2-one 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

2-(4-methoxyphenyl)-N-(pyridin-3-yl)acetamide
CID 799060
N-[(1R)-1-(3-methoxyphenyl)ethyl]-4-pyridin-4-ylcyclohexane-1-carboxamide
CID 168280932
N-[4-(4-Methoxy-phenyl)-1-pyridin-3-ylmethyl-piperidin-4-yl]-acetamide
CID 6487780
N-(4-methoxybenzyl)-3-phenyl-2-(1H-pyrrol-1-yl)propanamide
CID 16194135
4-Acetyl-3-hydroxy-5-(4-methoxy-phenyl)-1-pyridin-3-ylmethyl-1,5-dihydro-pyrrol-2-one
CID 3141388
2-(4-Methoxyphenyl)-5-pentylpyridine
CID 2058335
3-(3-Dimethylamino-propyl)-4-methoxy-N-(4-pyridin-4-yl-phenyl)-benzamide
CID 10068933
4-[[Acetyl[[4-(tetradecyloxy)phenyl]methyl]amino]methyl]-1-methylpyridinium iodide
CID 10348470
5-(4-methoxyphenyl)-6-(4-pyridyl) 3-phenyl-1-methyl-1H-pyridin-2-one
CID 10761534
(E)-5,5-bis(4-methoxyphenyl)-N-[4-(3-pyridinyl) butyl]-2,4-pentadienamide
CID 14347337
(E)-5,5-bis(4-methoxyphenyl)-N-[1,1-dimethyl-4-(3-pyridinyl)butyl]-2,4-pentadienamide
CID 14347338
5,5-Bis-(4-methoxy-phenyl)-penta-2,4-dienoic acid (1-methyl-4-pyridin-3-yl-butyl)-amide
CID 14347357

Frequently Asked Questions

What is the IUPAC name of (3R,4S)-4-(4-methoxyphenyl)-1-phenyl-3-(3-pyridin-3-ylpropyl)azetidin-2-one?
The IUPAC name of (3R,4S)-4-(4-methoxyphenyl)-1-phenyl-3-(3-pyridin-3-ylpropyl)azetidin-2-one (CID 15481172) is (3R,4S)-4-(4-methoxyphenyl)-1-phenyl-3-(3-pyridin-3-ylpropyl)azetidin-2-one.
What is the SMILES notation for (3R,4S)-4-(4-methoxyphenyl)-1-phenyl-3-(3-pyridin-3-ylpropyl)azetidin-2-one?
The canonical SMILES for (3R,4S)-4-(4-methoxyphenyl)-1-phenyl-3-(3-pyridin-3-ylpropyl)azetidin-2-one is COc1ccc([C@@H]2[C@@H](CCCc3cccnc3)C(=O)N2c2ccccc2)cc1.
What is the InChIKey of (3R,4S)-4-(4-methoxyphenyl)-1-phenyl-3-(3-pyridin-3-ylpropyl)azetidin-2-one?
The InChIKey is FSJVGFSWFAWCEC-DHIUTWEWSA-N. The full InChI is InChI=1S/C24H24N2O2/c1-28-21-14-12-19(13-15-21)23-22(11-5-7-18-8-6-16-25-17-18)24(27)26(23)20-9-3-2-4-10-20/h2-4,6,8-10,12-17,22-23H,5,7,11H2,1H3/t22-,23-/m1/s1.
What are the key properties of (3R,4S)-4-(4-methoxyphenyl)-1-phenyl-3-(3-pyridin-3-ylpropyl)azetidin-2-one?
(3R,4S)-4-(4-methoxyphenyl)-1-phenyl-3-(3-pyridin-3-ylpropyl)azetidin-2-one has a molecular weight of 372.47 g/mol, XLogP of 4.82, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4S)-4-(4-methoxyphenyl)-1-phenyl-3-(3-pyridin-3-ylpropyl)azetidin-2-one is sourced from PubChem (CID 15481172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).