N-(4-cyano-3-fluoro-5-methylphenyl)acetamide

C10H9FN2O — CID 127264492

IUPACN-(4-cyano-3-fluoro-5-methylphenyl)acetamide
SMILESCC(=O)Nc1cc(C)c(C#N)c(F)c1
InChIInChI=1S/C10H9FN2O/c1-6-3-8(13-7(2)14)4-10(11)9(6)5-12/h3-4H,1-2H3,(H,13,14)
InChIKeyRNWQFKVMVJYBBW-UHFFFAOYSA-N
MW192.19 g/mol
LogP1.96
Rot. Bonds1

About N-(4-cyano-3-fluoro-5-methylphenyl)acetamide

N-(4-cyano-3-fluoro-5-methylphenyl)acetamide (PubChem CID 127264492) has the molecular formula C10H9FN2O and a molecular weight of 192.19 g/mol. Its IUPAC name is N-(4-cyano-3-fluoro-5-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(4-cyano-3-fluoro-5-methylphenyl)acetamide
PubChem CID127264492
Molecular FormulaC10H9FN2O
Molecular Weight192.19 g/mol
Exact Mass192.07
IUPAC NameN-(4-cyano-3-fluoro-5-methylphenyl)acetamide
SMILESCC(=O)Nc1cc(C)c(C#N)c(F)c1
InChIInChI=1S/C10H9FN2O/c1-6-3-8(13-7(2)14)4-10(11)9(6)5-12/h3-4H,1-2H3,(H,13,14)
InChIKeyRNWQFKVMVJYBBW-UHFFFAOYSA-N
XLogP1.96
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.19
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-Methylphenyl)acetamide
CID 10843
4-Methylacetanilide
CID 7684
N-2-Naphthalenylacetamide
CID 11394
4-Acetamidophenylacetonitrile
CID 289748
N-(4-cyanophenyl)acetamide
CID 37256
Acetamide, N-(3-(trifluoromethyl)phenyl)-
CID 9595
3',4'-Dimethylacetanilide
CID 75144
2',3'-Acetoxylidide
CID 8656
N-(4-(2,2-Dicyanoethenyl)phenyl)acetamide
CID 33296
N-[4-(trifluoromethyl)phenyl]acetamide
CID 67685
Acetamide, N-(4-butylphenyl)-
CID 77227
N-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 299693

Frequently Asked Questions

What is the IUPAC name of N-(4-cyano-3-fluoro-5-methylphenyl)acetamide?
The IUPAC name of N-(4-cyano-3-fluoro-5-methylphenyl)acetamide (CID 127264492) is N-(4-cyano-3-fluoro-5-methylphenyl)acetamide.
What is the SMILES notation for N-(4-cyano-3-fluoro-5-methylphenyl)acetamide?
The canonical SMILES for N-(4-cyano-3-fluoro-5-methylphenyl)acetamide is CC(=O)Nc1cc(C)c(C#N)c(F)c1.
What is the InChIKey of N-(4-cyano-3-fluoro-5-methylphenyl)acetamide?
The InChIKey is RNWQFKVMVJYBBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O/c1-6-3-8(13-7(2)14)4-10(11)9(6)5-12/h3-4H,1-2H3,(H,13,14).
What are the key properties of N-(4-cyano-3-fluoro-5-methylphenyl)acetamide?
N-(4-cyano-3-fluoro-5-methylphenyl)acetamide has a molecular weight of 192.19 g/mol, XLogP of 1.96, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyano-3-fluoro-5-methylphenyl)acetamide is sourced from PubChem (CID 127264492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).