N-(2-methyl-1-phenylprop-1-enyl)acetamide

C12H15NO — CID 2825195

IUPACN-(2-methyl-1-phenylprop-1-enyl)acetamide
SMILESCC(=O)NC(=C(C)C)c1ccccc1
InChIInChI=1S/C12H15NO/c1-9(2)12(13-10(3)14)11-7-5-4-6-8-11/h4-8H,1-3H3,(H,13,14)
InChIKeyLXLYLKODCRUNIR-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.57
Rot. Bonds2

About N-(2-methyl-1-phenylprop-1-enyl)acetamide

N-(2-methyl-1-phenylprop-1-enyl)acetamide (PubChem CID 2825195) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is N-(2-methyl-1-phenylprop-1-enyl)acetamide.

Molecular Properties

Compound NameN-(2-methyl-1-phenylprop-1-enyl)acetamide
PubChem CID2825195
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC NameN-(2-methyl-1-phenylprop-1-enyl)acetamide
SMILESCC(=O)NC(=C(C)C)c1ccccc1
InChIInChI=1S/C12H15NO/c1-9(2)12(13-10(3)14)11-7-5-4-6-8-11/h4-8H,1-3H3,(H,13,14)
InChIKeyLXLYLKODCRUNIR-UHFFFAOYSA-N
XLogP2.57
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(3-Methylphenyl)acetamide
CID 10843
4-Methylacetanilide
CID 7684
N-acetyl-o-toluidine
CID 8443
N-(2-phenylethyl)acetamide
CID 70143
N-Acetyl-2,6-xylidine
CID 16616
O-Ethylacetanilide
CID 36332
Acetylamphetamine
CID 26660
N-Benzylacetamide
CID 11500
Acetamide, N-(4-butylphenyl)-
CID 77227
6-Phenyl-2-pyridone
CID 87889
N-Benzylacrylamide
CID 139428
4-Methyl-2-oxo-6-phenyl-1,2-dihydro-3-pyridinecarbonitrile
CID 2814576

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-1-phenylprop-1-enyl)acetamide?
The IUPAC name of N-(2-methyl-1-phenylprop-1-enyl)acetamide (CID 2825195) is N-(2-methyl-1-phenylprop-1-enyl)acetamide.
What is the SMILES notation for N-(2-methyl-1-phenylprop-1-enyl)acetamide?
The canonical SMILES for N-(2-methyl-1-phenylprop-1-enyl)acetamide is CC(=O)NC(=C(C)C)c1ccccc1.
What is the InChIKey of N-(2-methyl-1-phenylprop-1-enyl)acetamide?
The InChIKey is LXLYLKODCRUNIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO/c1-9(2)12(13-10(3)14)11-7-5-4-6-8-11/h4-8H,1-3H3,(H,13,14).
What are the key properties of N-(2-methyl-1-phenylprop-1-enyl)acetamide?
N-(2-methyl-1-phenylprop-1-enyl)acetamide has a molecular weight of 189.26 g/mol, XLogP of 2.57, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-1-phenylprop-1-enyl)acetamide is sourced from PubChem (CID 2825195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).