(4-fluoro-2-methylphenyl)-(1,3-oxazolidin-3-yl)methanone

C11H12FNO2 — CID 130766014

IUPAC(4-fluoro-2-methylphenyl)-(1,3-oxazolidin-3-yl)methanone
SMILESCc1cc(F)ccc1C(=O)N1CCOC1
InChIInChI=1S/C11H12FNO2/c1-8-6-9(12)2-3-10(8)11(14)13-4-5-15-7-13/h2-3,6H,4-5,7H2,1H3
InChIKeyDRUGOISGIYALDS-UHFFFAOYSA-N
MW209.22 g/mol
LogP1.56
Rot. Bonds1

About (4-fluoro-2-methylphenyl)-(1,3-oxazolidin-3-yl)methanone

(4-fluoro-2-methylphenyl)-(1,3-oxazolidin-3-yl)methanone (PubChem CID 130766014) has the molecular formula C11H12FNO2 and a molecular weight of 209.22 g/mol. Its IUPAC name is (4-fluoro-2-methylphenyl)-(1,3-oxazolidin-3-yl)methanone.

Molecular Properties

Compound Name(4-fluoro-2-methylphenyl)-(1,3-oxazolidin-3-yl)methanone
PubChem CID130766014
Molecular FormulaC11H12FNO2
Molecular Weight209.22 g/mol
Exact Mass209.09
IUPAC Name(4-fluoro-2-methylphenyl)-(1,3-oxazolidin-3-yl)methanone
SMILESCc1cc(F)ccc1C(=O)N1CCOC1
InChIInChI=1S/C11H12FNO2/c1-8-6-9(12)2-3-10(8)11(14)13-4-5-15-7-13/h2-3,6H,4-5,7H2,1H3
InChIKeyDRUGOISGIYALDS-UHFFFAOYSA-N
XLogP1.56
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.22
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

azetidin-1-yl-(4-fluoro-2-methylphenyl)methanone
CID 130163592
azepan-1-yl-(4-fluoro-2-methylphenyl)methanone
CID 112702240
(4-fluoro-2-methylphenyl)-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)methanone
CID 106313557
(5-fluoro-2-hydroxyphenyl)-(1,3-oxazinan-3-yl)methanone
CID 126772952
(4-fluoro-2-methylphenyl)-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)methanone
CID 115768398
(4-fluoro-2-methylphenyl)-(3-hydroxy-3-methylpyrrolidin-1-yl)methanone
CID 103820490
(2-bromo-3-methylphenyl)-(1,3-oxazolidin-3-yl)methanone
CID 130965206
1-[4-(4-fluoro-2-methylbenzoyl)-1,4-diazepan-1-yl]propan-1-one
CID 115745793
(4-fluoro-2-methylphenyl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone
CID 115745976
(2R)-6-(4-fluoro-2-methylbenzoyl)-6-azaspiro[2.5]octane-2-carboxylic acid
CID 129469820
1-(4-fluoro-2-methylphenyl)ethanone
CID 3494772
(3,3-diethylpyrrolidin-1-yl)-(4-fluoro-2-methylphenyl)methanone
CID 112702471

Frequently Asked Questions

What is the IUPAC name of (4-fluoro-2-methylphenyl)-(1,3-oxazolidin-3-yl)methanone?
The IUPAC name of (4-fluoro-2-methylphenyl)-(1,3-oxazolidin-3-yl)methanone (CID 130766014) is (4-fluoro-2-methylphenyl)-(1,3-oxazolidin-3-yl)methanone.
What is the SMILES notation for (4-fluoro-2-methylphenyl)-(1,3-oxazolidin-3-yl)methanone?
The canonical SMILES for (4-fluoro-2-methylphenyl)-(1,3-oxazolidin-3-yl)methanone is Cc1cc(F)ccc1C(=O)N1CCOC1.
What is the InChIKey of (4-fluoro-2-methylphenyl)-(1,3-oxazolidin-3-yl)methanone?
The InChIKey is DRUGOISGIYALDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FNO2/c1-8-6-9(12)2-3-10(8)11(14)13-4-5-15-7-13/h2-3,6H,4-5,7H2,1H3.
What are the key properties of (4-fluoro-2-methylphenyl)-(1,3-oxazolidin-3-yl)methanone?
(4-fluoro-2-methylphenyl)-(1,3-oxazolidin-3-yl)methanone has a molecular weight of 209.22 g/mol, XLogP of 1.56, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-2-methylphenyl)-(1,3-oxazolidin-3-yl)methanone is sourced from PubChem (CID 130766014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).