2-(N-acetyl-3-methylanilino)-N-cyclopropylacetamide

C14H18N2O2 — CID 113167455

IUPAC2-(N-acetyl-3-methylanilino)-N-cyclopropylacetamide
SMILESCC(=O)N(CC(=O)NC1CC1)c1cccc(C)c1
InChIInChI=1S/C14H18N2O2/c1-10-4-3-5-13(8-10)16(11(2)17)9-14(18)15-12-6-7-12/h3-5,8,12H,6-7,9H2,1-2H3,(H,15,18)
InChIKeyFIJWFNYXKWTWST-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.63
Rot. Bonds4

About 2-(N-acetyl-3-methylanilino)-N-cyclopropylacetamide

2-(N-acetyl-3-methylanilino)-N-cyclopropylacetamide (PubChem CID 113167455) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 2-(N-acetyl-3-methylanilino)-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-(N-acetyl-3-methylanilino)-N-cyclopropylacetamide
PubChem CID113167455
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name2-(N-acetyl-3-methylanilino)-N-cyclopropylacetamide
SMILESCC(=O)N(CC(=O)NC1CC1)c1cccc(C)c1
InChIInChI=1S/C14H18N2O2/c1-10-4-3-5-13(8-10)16(11(2)17)9-14(18)15-12-6-7-12/h3-5,8,12H,6-7,9H2,1-2H3,(H,15,18)
InChIKeyFIJWFNYXKWTWST-UHFFFAOYSA-N
XLogP1.63
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-N'-ethyl-N'-(3-methylphenyl)propanediamide
CID 108941153
2-(N-acetyl-3,4-dimethylanilino)-N-cyclopropylacetamide
CID 113168237
N-cyclohexyl-2-(N,3-diacetylanilino)acetamide
CID 113175380
2-(N-acetylanilino)-N-cyclopentylacetamide
CID 113167073
N-cyclopentyl-N'-ethyl-N'-(3-methylphenyl)propanediamide
CID 108942305
2-(N-acetyl-3-methoxyanilino)-N-cycloheptylacetamide
CID 113173369
methyl 3-[acetyl-[2-(cycloheptylamino)-2-oxoethyl]amino]benzoate
CID 113176252
N-cycloheptyl-2-(N-ethyl-3-methylanilino)acetamide
CID 109005664
2-(N-acetyl-3,4-dimethylanilino)-N-cyclohexylacetamide
CID 113168245
2-(N-acetyl-2,3-dimethylanilino)-N-cyclopropylacetamide
CID 113168819
2-(N-acetyl-3-methylanilino)-N-(3-chlorophenyl)acetamide
CID 113167570
2-(N-acetyl-2,6-dichloroanilino)-N-cyclopropylacetamide
CID 113179941

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-3-methylanilino)-N-cyclopropylacetamide?
The IUPAC name of 2-(N-acetyl-3-methylanilino)-N-cyclopropylacetamide (CID 113167455) is 2-(N-acetyl-3-methylanilino)-N-cyclopropylacetamide.
What is the SMILES notation for 2-(N-acetyl-3-methylanilino)-N-cyclopropylacetamide?
The canonical SMILES for 2-(N-acetyl-3-methylanilino)-N-cyclopropylacetamide is CC(=O)N(CC(=O)NC1CC1)c1cccc(C)c1.
What is the InChIKey of 2-(N-acetyl-3-methylanilino)-N-cyclopropylacetamide?
The InChIKey is FIJWFNYXKWTWST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-10-4-3-5-13(8-10)16(11(2)17)9-14(18)15-12-6-7-12/h3-5,8,12H,6-7,9H2,1-2H3,(H,15,18).
What are the key properties of 2-(N-acetyl-3-methylanilino)-N-cyclopropylacetamide?
2-(N-acetyl-3-methylanilino)-N-cyclopropylacetamide has a molecular weight of 246.31 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-3-methylanilino)-N-cyclopropylacetamide is sourced from PubChem (CID 113167455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).