2-(3-fluorophenyl)-2-methyl-1,3-oxazolidine;hydrochloride

C10H13ClFNO — CID 117227522

IUPAC2-(3-fluorophenyl)-2-methyl-1,3-oxazolidine;hydrochloride
SMILESCC1(c2cccc(F)c2)NCCO1.Cl
InChIInChI=1S/C10H12FNO.ClH/c1-10(12-5-6-13-10)8-3-2-4-9(11)7-8;/h2-4,7,12H,5-6H2,1H3;1H
InChIKeyWWAOFVTXTCQUHZ-UHFFFAOYSA-N
MW217.67 g/mol
LogP2.04
Rot. Bonds1

About 2-(3-fluorophenyl)-2-methyl-1,3-oxazolidine;hydrochloride

2-(3-fluorophenyl)-2-methyl-1,3-oxazolidine;hydrochloride (PubChem CID 117227522) has the molecular formula C10H13ClFNO and a molecular weight of 217.67 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-2-methyl-1,3-oxazolidine;hydrochloride.

Molecular Properties

Compound Name2-(3-fluorophenyl)-2-methyl-1,3-oxazolidine;hydrochloride
PubChem CID117227522
Molecular FormulaC10H13ClFNO
Molecular Weight217.67 g/mol
Exact Mass217.07
IUPAC Name2-(3-fluorophenyl)-2-methyl-1,3-oxazolidine;hydrochloride
SMILESCC1(c2cccc(F)c2)NCCO1.Cl
InChIInChI=1S/C10H12FNO.ClH/c1-10(12-5-6-13-10)8-3-2-4-9(11)7-8;/h2-4,7,12H,5-6H2,1H3;1H
InChIKeyWWAOFVTXTCQUHZ-UHFFFAOYSA-N
XLogP2.04
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.67
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(3-fluorophenyl)-2-methyl-1,3-oxazolidine;hydrochloride 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 2-(3-fluorophenyl)-2-methyl-1,3-oxazolidine;hydrochloride?
The IUPAC name of 2-(3-fluorophenyl)-2-methyl-1,3-oxazolidine;hydrochloride (CID 117227522) is 2-(3-fluorophenyl)-2-methyl-1,3-oxazolidine;hydrochloride.
What is the SMILES notation for 2-(3-fluorophenyl)-2-methyl-1,3-oxazolidine;hydrochloride?
The canonical SMILES for 2-(3-fluorophenyl)-2-methyl-1,3-oxazolidine;hydrochloride is CC1(c2cccc(F)c2)NCCO1.Cl.
What is the InChIKey of 2-(3-fluorophenyl)-2-methyl-1,3-oxazolidine;hydrochloride?
The InChIKey is WWAOFVTXTCQUHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO.ClH/c1-10(12-5-6-13-10)8-3-2-4-9(11)7-8;/h2-4,7,12H,5-6H2,1H3;1H.
What are the key properties of 2-(3-fluorophenyl)-2-methyl-1,3-oxazolidine;hydrochloride?
2-(3-fluorophenyl)-2-methyl-1,3-oxazolidine;hydrochloride has a molecular weight of 217.67 g/mol, XLogP of 2.04, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-2-methyl-1,3-oxazolidine;hydrochloride is sourced from PubChem (CID 117227522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).