(4S,5S)-5-(3-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one

C10H10ClNO2 — CID 134527726

IUPAC(4S,5S)-5-(3-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one
SMILESC[C@@H]1NC(=O)O[C@H]1c1cccc(Cl)c1
InChIInChI=1S/C10H10ClNO2/c1-6-9(14-10(13)12-6)7-3-2-4-8(11)5-7/h2-6,9H,1H3,(H,12,13)/t6-,9+/m0/s1
InChIKeyCMCNYNGZYJTEKH-IMTBSYHQSA-N
MW211.65 g/mol
LogP2.51
Rot. Bonds1

About (4S,5S)-5-(3-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one

(4S,5S)-5-(3-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one (PubChem CID 134527726) has the molecular formula C10H10ClNO2 and a molecular weight of 211.65 g/mol. Its IUPAC name is (4S,5S)-5-(3-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(4S,5S)-5-(3-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one
PubChem CID134527726
Molecular FormulaC10H10ClNO2
Molecular Weight211.65 g/mol
Exact Mass211.04
IUPAC Name(4S,5S)-5-(3-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one
SMILESC[C@@H]1NC(=O)O[C@H]1c1cccc(Cl)c1
InChIInChI=1S/C10H10ClNO2/c1-6-9(14-10(13)12-6)7-3-2-4-8(11)5-7/h2-6,9H,1H3,(H,12,13)/t6-,9+/m0/s1
InChIKeyCMCNYNGZYJTEKH-IMTBSYHQSA-N
XLogP2.51
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.65
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4S,5S)-5-(3-chlorophenyl)-4-methyl-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

Related Compounds

(5R)-5-(3,5-dichlorophenyl)-4-methyl-1,3-oxazolidin-2-one
CID 70899650
4-methyl-5-[3-(trifluoromethyl)phenyl]-1,3-oxazolidin-2-one
CID 77401770
(4R)-4-(4-chloro-2-fluorophenyl)-5-(3-chlorophenyl)-1,3-oxazolidin-2-one
CID 122684505
(2R,3S)-2-(3-chlorophenyl)-3-methyloxirane
CID 30122314
2-(3-chlorophenyl)-3,5,5-trimethylmorpholine
CID 43366940
3-(3-chlorophenyl)-2,9-dimethyl-4-oxa-1-azaspiro[5.5]undecane
CID 62527338
6-chloro-2-(3-chlorophenyl)-7-fluoro-3-methyl-3,4-dihydro-2H-1,4-benzoxazine
CID 82720778
(4S,5S)-5-(6-chloro-2-pyridinyl)-4-methyl-1,3-oxazolidin-2-one
CID 88580234
(4S,5S)-4-methyl-5-(4-methylsulfanylphenyl)-1,3-oxazolidin-2-one
CID 59786579
(4S,5S)-5-(5-chlorothiophen-2-yl)-4-methyl-1,3-oxazolidin-2-one
CID 67066013
(5S)-4-methyl-5-[4-(trifluoromethyl)phenyl]-1,3-oxazolidin-2-one
CID 69224006
(4S,5R)-4-methyl-5-(4-nitrophenyl)-1,3-oxazolidin-2-one
CID 13307960

Frequently Asked Questions

What is the IUPAC name of (4S,5S)-5-(3-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one?
The IUPAC name of (4S,5S)-5-(3-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one (CID 134527726) is (4S,5S)-5-(3-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one.
What is the SMILES notation for (4S,5S)-5-(3-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one?
The canonical SMILES for (4S,5S)-5-(3-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one is C[C@@H]1NC(=O)O[C@H]1c1cccc(Cl)c1.
What is the InChIKey of (4S,5S)-5-(3-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one?
The InChIKey is CMCNYNGZYJTEKH-IMTBSYHQSA-N. The full InChI is InChI=1S/C10H10ClNO2/c1-6-9(14-10(13)12-6)7-3-2-4-8(11)5-7/h2-6,9H,1H3,(H,12,13)/t6-,9+/m0/s1.
What are the key properties of (4S,5S)-5-(3-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one?
(4S,5S)-5-(3-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one has a molecular weight of 211.65 g/mol, XLogP of 2.51, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4S,5S)-5-(3-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 134527726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).