N-(6-chloro-2-fluoro-3-methylphenyl)acetamide

C9H9ClFNO — CID 67957585

IUPACN-(6-chloro-2-fluoro-3-methylphenyl)acetamide
SMILESCC(=O)Nc1c(Cl)ccc(C)c1F
InChIInChI=1S/C9H9ClFNO/c1-5-3-4-7(10)9(8(5)11)12-6(2)13/h3-4H,1-2H3,(H,12,13)
InChIKeyASVSDSPPTWUJQD-UHFFFAOYSA-N
MW201.63 g/mol
LogP2.75
Rot. Bonds1

About N-(6-chloro-2-fluoro-3-methylphenyl)acetamide

N-(6-chloro-2-fluoro-3-methylphenyl)acetamide (PubChem CID 67957585) has the molecular formula C9H9ClFNO and a molecular weight of 201.63 g/mol. Its IUPAC name is N-(6-chloro-2-fluoro-3-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(6-chloro-2-fluoro-3-methylphenyl)acetamide
PubChem CID67957585
Molecular FormulaC9H9ClFNO
Molecular Weight201.63 g/mol
Exact Mass201.04
IUPAC NameN-(6-chloro-2-fluoro-3-methylphenyl)acetamide
SMILESCC(=O)Nc1c(Cl)ccc(C)c1F
InChIInChI=1S/C9H9ClFNO/c1-5-3-4-7(10)9(8(5)11)12-6(2)13/h3-4H,1-2H3,(H,12,13)
InChIKeyASVSDSPPTWUJQD-UHFFFAOYSA-N
XLogP2.75
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.63
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3-bromo-6-chloro-2-fluorophenyl)carbamic acid
CID 18451550
N-(2,6-dichloro-3-methylphenyl)-4-fluorobenzamide
CID 60628486
N-(2,3,4-trichloro-6-methylphenyl)acetamide
CID 88800520
6-chloro-2-fluoro-3-methyl-N-pyridin-4-ylbenzamide
CID 59618078
N-(3,6-dichloro-2-nitrophenyl)acetamide
CID 70604003
N-[3-chloro-6-(hydroxymethyl)-2-methylphenyl]acetamide
CID 22890268
N-(4-chloro-2,6-dimethylphenyl)acetamide;ethane
CID 156737682
N-(4-chloro-3-fluorophenyl)acetamide
CID 60776248
2-chloro-1-(6-chloro-2-fluoro-3-methylphenyl)ethanone
CID 130775413
N-(2-chloro-5-fluorophenyl)acetamide
CID 102458235
3-(2,6-dichloro-3-methylanilino)-3-oxopropanoic acid
CID 62231070
N-(2-chloro-6-ethylphenyl)acetamide
CID 130011952

Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-2-fluoro-3-methylphenyl)acetamide?
The IUPAC name of N-(6-chloro-2-fluoro-3-methylphenyl)acetamide (CID 67957585) is N-(6-chloro-2-fluoro-3-methylphenyl)acetamide.
What is the SMILES notation for N-(6-chloro-2-fluoro-3-methylphenyl)acetamide?
The canonical SMILES for N-(6-chloro-2-fluoro-3-methylphenyl)acetamide is CC(=O)Nc1c(Cl)ccc(C)c1F.
What is the InChIKey of N-(6-chloro-2-fluoro-3-methylphenyl)acetamide?
The InChIKey is ASVSDSPPTWUJQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9ClFNO/c1-5-3-4-7(10)9(8(5)11)12-6(2)13/h3-4H,1-2H3,(H,12,13).
What are the key properties of N-(6-chloro-2-fluoro-3-methylphenyl)acetamide?
N-(6-chloro-2-fluoro-3-methylphenyl)acetamide has a molecular weight of 201.63 g/mol, XLogP of 2.75, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-2-fluoro-3-methylphenyl)acetamide is sourced from PubChem (CID 67957585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).