2-(3-fluorophenyl)-4-methyl-1,3-oxazolidine

C10H12FNO — CID 82280855

IUPAC2-(3-fluorophenyl)-4-methyl-1,3-oxazolidine
SMILESCC1COC(c2cccc(F)c2)N1
InChIInChI=1S/C10H12FNO/c1-7-6-13-10(12-7)8-3-2-4-9(11)5-8/h2-5,7,10,12H,6H2,1H3
InChIKeyVBSCPTSMOBPQEQ-UHFFFAOYSA-N
MW181.21 g/mol
LogP1.83
Rot. Bonds1

About 2-(3-fluorophenyl)-4-methyl-1,3-oxazolidine

2-(3-fluorophenyl)-4-methyl-1,3-oxazolidine (PubChem CID 82280855) has the molecular formula C10H12FNO and a molecular weight of 181.21 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-4-methyl-1,3-oxazolidine.

Molecular Properties

Compound Name2-(3-fluorophenyl)-4-methyl-1,3-oxazolidine
PubChem CID82280855
Molecular FormulaC10H12FNO
Molecular Weight181.21 g/mol
Exact Mass181.09
IUPAC Name2-(3-fluorophenyl)-4-methyl-1,3-oxazolidine
SMILESCC1COC(c2cccc(F)c2)N1
InChIInChI=1S/C10H12FNO/c1-7-6-13-10(12-7)8-3-2-4-9(11)5-8/h2-5,7,10,12H,6H2,1H3
InChIKeyVBSCPTSMOBPQEQ-UHFFFAOYSA-N
XLogP1.83
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.21
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-ethoxyphenyl)-4-methyl-1,3-oxazolidine
CID 82283427
4-methyl-2-pyridin-4-yl-1,3-oxazolidine;hydrochloride
CID 117228645
4-(3-fluorophenyl)-1,2-oxazolidine
CID 105433367
2-(3-fluorophenyl)-3,6-dimethyl-1,4-oxazepane
CID 114872204
2-[4-(3-fluorophenyl)cyclohexyl]-5-methyloxane
CID 142899993
(5S)-2-(3-fluorophenyl)-3,4,5-trimethylmorpholine
CID 67655096
(2S,3S,5R)-2-(3-fluorophenyl)-3,4,5-trimethylmorpholine;hydrochloride
CID 67706284
3-(3-fluorophenyl)-5-methyl-1,4-thiazinane 1,1-dioxide
CID 66217456
[2-(3-fluorophenyl)-1,3-dioxan-5-yl]phosphane
CID 144750107
2-(3-fluorophenyl)-3,6-dimethylmorpholine
CID 114872193
2-(3-fluorophenyl)-2,4-dimethyl-1,3-oxazolidine
CID 117228450
2-(3-fluorophenyl)-4-methylmorpholine
CID 77271439

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-4-methyl-1,3-oxazolidine?
The IUPAC name of 2-(3-fluorophenyl)-4-methyl-1,3-oxazolidine (CID 82280855) is 2-(3-fluorophenyl)-4-methyl-1,3-oxazolidine.
What is the SMILES notation for 2-(3-fluorophenyl)-4-methyl-1,3-oxazolidine?
The canonical SMILES for 2-(3-fluorophenyl)-4-methyl-1,3-oxazolidine is CC1COC(c2cccc(F)c2)N1.
What is the InChIKey of 2-(3-fluorophenyl)-4-methyl-1,3-oxazolidine?
The InChIKey is VBSCPTSMOBPQEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO/c1-7-6-13-10(12-7)8-3-2-4-9(11)5-8/h2-5,7,10,12H,6H2,1H3.
What are the key properties of 2-(3-fluorophenyl)-4-methyl-1,3-oxazolidine?
2-(3-fluorophenyl)-4-methyl-1,3-oxazolidine has a molecular weight of 181.21 g/mol, XLogP of 1.83, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-4-methyl-1,3-oxazolidine is sourced from PubChem (CID 82280855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).