2-chloro-6-fluoro-N-[2-methyl-2-(2-oxo-1,3-oxazolidin-3-yl)propyl]benzamide

C14H16ClFN2O3 — CID 110719411

IUPAC2-chloro-6-fluoro-N-[2-methyl-2-(2-oxo-1,3-oxazolidin-3-yl)propyl]benzamide
SMILESCC(C)(CNC(=O)c1c(F)cccc1Cl)N1CCOC1=O
InChIInChI=1S/C14H16ClFN2O3/c1-14(2,18-6-7-21-13(18)20)8-17-12(19)11-9(15)4-3-5-10(11)16/h3-5H,6-8H2,1-2H3,(H,17,19)
InChIKeyBAGQSKJEGMWIBA-UHFFFAOYSA-N
MW314.74 g/mol
LogP2.44
Rot. Bonds4

About 2-chloro-6-fluoro-N-[2-methyl-2-(2-oxo-1,3-oxazolidin-3-yl)propyl]benzamide

2-chloro-6-fluoro-N-[2-methyl-2-(2-oxo-1,3-oxazolidin-3-yl)propyl]benzamide (PubChem CID 110719411) has the molecular formula C14H16ClFN2O3 and a molecular weight of 314.74 g/mol. Its IUPAC name is 2-chloro-6-fluoro-N-[2-methyl-2-(2-oxo-1,3-oxazolidin-3-yl)propyl]benzamide.

Molecular Properties

Compound Name2-chloro-6-fluoro-N-[2-methyl-2-(2-oxo-1,3-oxazolidin-3-yl)propyl]benzamide
PubChem CID110719411
Molecular FormulaC14H16ClFN2O3
Molecular Weight314.74 g/mol
Exact Mass314.08
IUPAC Name2-chloro-6-fluoro-N-[2-methyl-2-(2-oxo-1,3-oxazolidin-3-yl)propyl]benzamide
SMILESCC(C)(CNC(=O)c1c(F)cccc1Cl)N1CCOC1=O
InChIInChI=1S/C14H16ClFN2O3/c1-14(2,18-6-7-21-13(18)20)8-17-12(19)11-9(15)4-3-5-10(11)16/h3-5H,6-8H2,1-2H3,(H,17,19)
InChIKeyBAGQSKJEGMWIBA-UHFFFAOYSA-N
XLogP2.44
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.74
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-[2-methyl-2-(2-oxo-1,3-oxazolidin-3-yl)propyl]benzamide
CID 110719406
2,6-dimethoxy-N-[2-methyl-2-(2-oxo-1,3-oxazolidin-3-yl)propyl]benzamide
CID 110719392
3-[(2-chloro-6-fluorobenzoyl)amino]-2,2-dimethylpropanoic acid
CID 81367390
3-[(2-chloro-6-fluorobenzoyl)amino]-2-hydroxy-2-methylpropanoic acid
CID 66172745
2-chloro-N-(2-cyclopropyl-2-hydroxypropyl)-6-fluorobenzamide
CID 52992747
2-chloro-6-fluoro-N-[2-(4-methoxyphenyl)-2-methylpropyl]benzamide
CID 113090462
2-chloro-6-fluoro-N-(2-methoxyethyl)benzamide
CID 17217215
2-chloro-6-fluoro-N-[2-hydroxy-2-(1-methylpyrazol-4-yl)propyl]benzamide
CID 111519861
N-(3-amino-2,2-difluoropropyl)-2-chloro-6-fluorobenzamide
CID 114383783
methyl 2-[(2-chloro-6-fluorobenzoyl)amino]acetate
CID 43423009
2-chloro-N-[2-(3,3-dimethylbutanoylamino)ethyl]-6-fluorobenzamide
CID 108575170
2-chloro-6-fluoro-N-(2-hydroxy-2-methyl-4-phenylbutyl)benzamide
CID 90498490

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-fluoro-N-[2-methyl-2-(2-oxo-1,3-oxazolidin-3-yl)propyl]benzamide?
The IUPAC name of 2-chloro-6-fluoro-N-[2-methyl-2-(2-oxo-1,3-oxazolidin-3-yl)propyl]benzamide (CID 110719411) is 2-chloro-6-fluoro-N-[2-methyl-2-(2-oxo-1,3-oxazolidin-3-yl)propyl]benzamide.
What is the SMILES notation for 2-chloro-6-fluoro-N-[2-methyl-2-(2-oxo-1,3-oxazolidin-3-yl)propyl]benzamide?
The canonical SMILES for 2-chloro-6-fluoro-N-[2-methyl-2-(2-oxo-1,3-oxazolidin-3-yl)propyl]benzamide is CC(C)(CNC(=O)c1c(F)cccc1Cl)N1CCOC1=O.
What is the InChIKey of 2-chloro-6-fluoro-N-[2-methyl-2-(2-oxo-1,3-oxazolidin-3-yl)propyl]benzamide?
The InChIKey is BAGQSKJEGMWIBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClFN2O3/c1-14(2,18-6-7-21-13(18)20)8-17-12(19)11-9(15)4-3-5-10(11)16/h3-5H,6-8H2,1-2H3,(H,17,19).
What are the key properties of 2-chloro-6-fluoro-N-[2-methyl-2-(2-oxo-1,3-oxazolidin-3-yl)propyl]benzamide?
2-chloro-6-fluoro-N-[2-methyl-2-(2-oxo-1,3-oxazolidin-3-yl)propyl]benzamide has a molecular weight of 314.74 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-fluoro-N-[2-methyl-2-(2-oxo-1,3-oxazolidin-3-yl)propyl]benzamide is sourced from PubChem (CID 110719411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).