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

C10H10N2O — CID 2737380

IUPACN-(4-cyano-3-methylphenyl)acetamide
SMILESCC(=O)Nc1ccc(C#N)c(C)c1
InChIInChI=1S/C10H10N2O/c1-7-5-10(12-8(2)13)4-3-9(7)6-11/h3-5H,1-2H3,(H,12,13)
InChIKeySRCREJLHAPEANJ-UHFFFAOYSA-N
MW174.20 g/mol
LogP1.83
Rot. Bonds1

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

N-(4-cyano-3-methylphenyl)acetamide (PubChem CID 2737380) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is N-(4-cyano-3-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(4-cyano-3-methylphenyl)acetamide
PubChem CID2737380
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC NameN-(4-cyano-3-methylphenyl)acetamide
SMILESCC(=O)Nc1ccc(C#N)c(C)c1
InChIInChI=1S/C10H10N2O/c1-7-5-10(12-8(2)13)4-3-9(7)6-11/h3-5H,1-2H3,(H,12,13)
InChIKeySRCREJLHAPEANJ-UHFFFAOYSA-N
XLogP1.83
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Acetylaminofluorene
CID 5897
N-(3-Methylphenyl)acetamide
CID 10843
4-Methylacetanilide
CID 7684
N-acetyl-o-toluidine
CID 8443
N,N'-Diacetylbenzidine
CID 11942
N-Acetyl-4-aminobiphenyl
CID 19998
Acetylbenzidine
CID 18787
O-Ethylacetanilide
CID 36332
N-2-Naphthalenylacetamide
CID 11394
Acetamide, N-1-naphthalenyl-
CID 68461
4-Acetamidophenylacetonitrile
CID 289748
N-(4-cyanophenyl)acetamide
CID 37256

Frequently Asked Questions

What is the IUPAC name of N-(4-cyano-3-methylphenyl)acetamide?
The IUPAC name of N-(4-cyano-3-methylphenyl)acetamide (CID 2737380) is N-(4-cyano-3-methylphenyl)acetamide.
What is the SMILES notation for N-(4-cyano-3-methylphenyl)acetamide?
The canonical SMILES for N-(4-cyano-3-methylphenyl)acetamide is CC(=O)Nc1ccc(C#N)c(C)c1.
What is the InChIKey of N-(4-cyano-3-methylphenyl)acetamide?
The InChIKey is SRCREJLHAPEANJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c1-7-5-10(12-8(2)13)4-3-9(7)6-11/h3-5H,1-2H3,(H,12,13).
What are the key properties of N-(4-cyano-3-methylphenyl)acetamide?
N-(4-cyano-3-methylphenyl)acetamide has a molecular weight of 174.20 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 N-(4-cyano-3-methylphenyl)acetamide is sourced from PubChem (CID 2737380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).