2-methyl-N-(2-methylprop-2-enyl)-2-phenylpropanamide

C14H19NO — CID 114618287

IUPAC2-methyl-N-(2-methylprop-2-enyl)-2-phenylpropanamide
SMILESC=C(C)CNC(=O)C(C)(C)c1ccccc1
InChIInChI=1S/C14H19NO/c1-11(2)10-15-13(16)14(3,4)12-8-6-5-7-9-12/h5-9H,1,10H2,2-4H3,(H,15,16)
InChIKeyVDPOTSXCYDVVIP-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.66
Rot. Bonds4

About 2-methyl-N-(2-methylprop-2-enyl)-2-phenylpropanamide

2-methyl-N-(2-methylprop-2-enyl)-2-phenylpropanamide (PubChem CID 114618287) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 2-methyl-N-(2-methylprop-2-enyl)-2-phenylpropanamide.

Molecular Properties

Compound Name2-methyl-N-(2-methylprop-2-enyl)-2-phenylpropanamide
PubChem CID114618287
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name2-methyl-N-(2-methylprop-2-enyl)-2-phenylpropanamide
SMILESC=C(C)CNC(=O)C(C)(C)c1ccccc1
InChIInChI=1S/C14H19NO/c1-11(2)10-15-13(16)14(3,4)12-8-6-5-7-9-12/h5-9H,1,10H2,2-4H3,(H,15,16)
InChIKeyVDPOTSXCYDVVIP-UHFFFAOYSA-N
XLogP2.66
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 2-methyl-N-(2-methylprop-2-enyl)-2-phenylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3,3-dimethyl-2-oxobutyl)-2-methyl-2-phenylpropanamide
CID 64991414
N-(2-acetamidoethyl)-2-methyl-2-phenylpropanamide
CID 110678562
2-methyl-4-(2-methylprop-2-enylamino)-4-oxo-2-phenylbutanoic acid
CID 114615278
N-(2-hydroxy-2-methylbutyl)-2-methyl-2-phenylpropanamide
CID 65114444
2-methyl-2-phenyl-N-[2-(propan-2-ylamino)ethyl]propanamide
CID 62659574
N-(4-bromobutyl)-2-methyl-2-phenylpropanamide
CID 106845643
2-methyl-2-phenyl-N-(3,3,3-trifluoro-2-hydroxypropyl)propanamide
CID 103730656
2-methyl-2-[4-(2-methylprop-2-enylamino)phenyl]propanoic acid
CID 10059881
N-[2-(aminomethyl)-2-ethylbutyl]-2-methyl-2-phenylpropanamide
CID 106250793
N-[(2-methyl-2-phenylpropanoyl)amino]formamide
CID 71020555
N-(2-amino-3-hydroxybutyl)-2-methyl-2-phenylpropanamide
CID 64539763
2-methyl-N-[2-(2-methylphenyl)ethyl]-2-phenylpropanamide
CID 46531773

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-methylprop-2-enyl)-2-phenylpropanamide?
The IUPAC name of 2-methyl-N-(2-methylprop-2-enyl)-2-phenylpropanamide (CID 114618287) is 2-methyl-N-(2-methylprop-2-enyl)-2-phenylpropanamide.
What is the SMILES notation for 2-methyl-N-(2-methylprop-2-enyl)-2-phenylpropanamide?
The canonical SMILES for 2-methyl-N-(2-methylprop-2-enyl)-2-phenylpropanamide is C=C(C)CNC(=O)C(C)(C)c1ccccc1.
What is the InChIKey of 2-methyl-N-(2-methylprop-2-enyl)-2-phenylpropanamide?
The InChIKey is VDPOTSXCYDVVIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-11(2)10-15-13(16)14(3,4)12-8-6-5-7-9-12/h5-9H,1,10H2,2-4H3,(H,15,16).
What are the key properties of 2-methyl-N-(2-methylprop-2-enyl)-2-phenylpropanamide?
2-methyl-N-(2-methylprop-2-enyl)-2-phenylpropanamide has a molecular weight of 217.31 g/mol, XLogP of 2.66, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methylprop-2-enyl)-2-phenylpropanamide is sourced from PubChem (CID 114618287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).