5-(4-chlorophenyl)-2,3-dimethyl-1,2-oxazolidine

C11H14ClNO — CID 90863476

IUPAC5-(4-chlorophenyl)-2,3-dimethyl-1,2-oxazolidine
SMILESCC1CC(c2ccc(Cl)cc2)ON1C
InChIInChI=1S/C11H14ClNO/c1-8-7-11(14-13(8)2)9-3-5-10(12)6-4-9/h3-6,8,11H,7H2,1-2H3
InChIKeyGIAGWVMLYZWEIL-UHFFFAOYSA-N
MW211.69 g/mol
LogP3.04
Rot. Bonds1

About 5-(4-chlorophenyl)-2,3-dimethyl-1,2-oxazolidine

5-(4-chlorophenyl)-2,3-dimethyl-1,2-oxazolidine (PubChem CID 90863476) has the molecular formula C11H14ClNO and a molecular weight of 211.69 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-2,3-dimethyl-1,2-oxazolidine.

Molecular Properties

Compound Name5-(4-chlorophenyl)-2,3-dimethyl-1,2-oxazolidine
PubChem CID90863476
Molecular FormulaC11H14ClNO
Molecular Weight211.69 g/mol
Exact Mass211.08
IUPAC Name5-(4-chlorophenyl)-2,3-dimethyl-1,2-oxazolidine
SMILESCC1CC(c2ccc(Cl)cc2)ON1C
InChIInChI=1S/C11H14ClNO/c1-8-7-11(14-13(8)2)9-3-5-10(12)6-4-9/h3-6,8,11H,7H2,1-2H3
InChIKeyGIAGWVMLYZWEIL-UHFFFAOYSA-N
XLogP3.04
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.69
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-2,3-dimethyl-1,2-oxazolidine?
The IUPAC name of 5-(4-chlorophenyl)-2,3-dimethyl-1,2-oxazolidine (CID 90863476) is 5-(4-chlorophenyl)-2,3-dimethyl-1,2-oxazolidine.
What is the SMILES notation for 5-(4-chlorophenyl)-2,3-dimethyl-1,2-oxazolidine?
The canonical SMILES for 5-(4-chlorophenyl)-2,3-dimethyl-1,2-oxazolidine is CC1CC(c2ccc(Cl)cc2)ON1C.
What is the InChIKey of 5-(4-chlorophenyl)-2,3-dimethyl-1,2-oxazolidine?
The InChIKey is GIAGWVMLYZWEIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClNO/c1-8-7-11(14-13(8)2)9-3-5-10(12)6-4-9/h3-6,8,11H,7H2,1-2H3.
What are the key properties of 5-(4-chlorophenyl)-2,3-dimethyl-1,2-oxazolidine?
5-(4-chlorophenyl)-2,3-dimethyl-1,2-oxazolidine has a molecular weight of 211.69 g/mol, XLogP of 3.04, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-2,3-dimethyl-1,2-oxazolidine is sourced from PubChem (CID 90863476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).