(4R,5S)-5-(2-methoxyphenyl)-4-(5-phenyl-3-pyridinyl)-1,3-oxazolidin-2-one

C21H18N2O3 — CID 69281923

IUPAC(4R,5S)-5-(2-methoxyphenyl)-4-(5-phenyl-3-pyridinyl)-1,3-oxazolidin-2-one
SMILESCOc1ccccc1[C@@H]1OC(=O)N[C@@H]1c1cncc(-c2ccccc2)c1
InChIInChI=1S/C21H18N2O3/c1-25-18-10-6-5-9-17(18)20-19(23-21(24)26-20)16-11-15(12-22-13-16)14-7-3-2-4-8-14/h2-13,19-20H,1H3,(H,23,24)/t19-,20+/m1/s1
InChIKeyHKWSZPJTNRPBJH-UXHICEINSA-N
MW346.39 g/mol
LogP4.28
Rot. Bonds4

About (4R,5S)-5-(2-methoxyphenyl)-4-(5-phenyl-3-pyridinyl)-1,3-oxazolidin-2-one

(4R,5S)-5-(2-methoxyphenyl)-4-(5-phenyl-3-pyridinyl)-1,3-oxazolidin-2-one (PubChem CID 69281923) has the molecular formula C21H18N2O3 and a molecular weight of 346.39 g/mol. Its IUPAC name is (4R,5S)-5-(2-methoxyphenyl)-4-(5-phenyl-3-pyridinyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(4R,5S)-5-(2-methoxyphenyl)-4-(5-phenyl-3-pyridinyl)-1,3-oxazolidin-2-one
PubChem CID69281923
Molecular FormulaC21H18N2O3
Molecular Weight346.39 g/mol
Exact Mass346.13
IUPAC Name(4R,5S)-5-(2-methoxyphenyl)-4-(5-phenyl-3-pyridinyl)-1,3-oxazolidin-2-one
SMILESCOc1ccccc1[C@@H]1OC(=O)N[C@@H]1c1cncc(-c2ccccc2)c1
InChIInChI=1S/C21H18N2O3/c1-25-18-10-6-5-9-17(18)20-19(23-21(24)26-20)16-11-15(12-22-13-16)14-7-3-2-4-8-14/h2-13,19-20H,1H3,(H,23,24)/t19-,20+/m1/s1
InChIKeyHKWSZPJTNRPBJH-UXHICEINSA-N
XLogP4.28
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.39
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (4R,5S)-5-(2-methoxyphenyl)-4-(5-phenyl-3-pyridinyl)-1,3-oxazolidin-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

Frequently Asked Questions

What is the IUPAC name of (4R,5S)-5-(2-methoxyphenyl)-4-(5-phenyl-3-pyridinyl)-1,3-oxazolidin-2-one?
The IUPAC name of (4R,5S)-5-(2-methoxyphenyl)-4-(5-phenyl-3-pyridinyl)-1,3-oxazolidin-2-one (CID 69281923) is (4R,5S)-5-(2-methoxyphenyl)-4-(5-phenyl-3-pyridinyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for (4R,5S)-5-(2-methoxyphenyl)-4-(5-phenyl-3-pyridinyl)-1,3-oxazolidin-2-one?
The canonical SMILES for (4R,5S)-5-(2-methoxyphenyl)-4-(5-phenyl-3-pyridinyl)-1,3-oxazolidin-2-one is COc1ccccc1[C@@H]1OC(=O)N[C@@H]1c1cncc(-c2ccccc2)c1.
What is the InChIKey of (4R,5S)-5-(2-methoxyphenyl)-4-(5-phenyl-3-pyridinyl)-1,3-oxazolidin-2-one?
The InChIKey is HKWSZPJTNRPBJH-UXHICEINSA-N. The full InChI is InChI=1S/C21H18N2O3/c1-25-18-10-6-5-9-17(18)20-19(23-21(24)26-20)16-11-15(12-22-13-16)14-7-3-2-4-8-14/h2-13,19-20H,1H3,(H,23,24)/t19-,20+/m1/s1.
What are the key properties of (4R,5S)-5-(2-methoxyphenyl)-4-(5-phenyl-3-pyridinyl)-1,3-oxazolidin-2-one?
(4R,5S)-5-(2-methoxyphenyl)-4-(5-phenyl-3-pyridinyl)-1,3-oxazolidin-2-one has a molecular weight of 346.39 g/mol, XLogP of 4.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,5S)-5-(2-methoxyphenyl)-4-(5-phenyl-3-pyridinyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 69281923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).