N-[(E)-hex-2-enyl]-2-methyl-N-(2-methylprop-1-enyl)propanamide

C14H25NO — CID 11775772

IUPACN-[(E)-hex-2-enyl]-2-methyl-N-(2-methylprop-1-enyl)propanamide
SMILESCCC/C=C/CN(C=C(C)C)C(=O)C(C)C
InChIInChI=1S/C14H25NO/c1-6-7-8-9-10-15(11-12(2)3)14(16)13(4)5/h8-9,11,13H,6-7,10H2,1-5H3/b9-8+
InChIKeyXVKRCZLHLQBATR-CMDGGOBGSA-N
MW223.36 g/mol
LogP3.75
Rot. Bonds6

About N-[(E)-hex-2-enyl]-2-methyl-N-(2-methylprop-1-enyl)propanamide

N-[(E)-hex-2-enyl]-2-methyl-N-(2-methylprop-1-enyl)propanamide (PubChem CID 11775772) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is N-[(E)-hex-2-enyl]-2-methyl-N-(2-methylprop-1-enyl)propanamide.

Molecular Properties

Compound NameN-[(E)-hex-2-enyl]-2-methyl-N-(2-methylprop-1-enyl)propanamide
PubChem CID11775772
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC NameN-[(E)-hex-2-enyl]-2-methyl-N-(2-methylprop-1-enyl)propanamide
SMILESCCC/C=C/CN(C=C(C)C)C(=O)C(C)C
InChIInChI=1S/C14H25NO/c1-6-7-8-9-10-15(11-12(2)3)14(16)13(4)5/h8-9,11,13H,6-7,10H2,1-5H3/b9-8+
InChIKeyXVKRCZLHLQBATR-CMDGGOBGSA-N
XLogP3.75
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-[(E)-hex-2-enyl]-2-methyl-N-(2-methylprop-1-enyl)propanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(E)-hex-2-enyl]-2-methyl-N-(2-methylprop-1-enyl)propanamide?
The IUPAC name of N-[(E)-hex-2-enyl]-2-methyl-N-(2-methylprop-1-enyl)propanamide (CID 11775772) is N-[(E)-hex-2-enyl]-2-methyl-N-(2-methylprop-1-enyl)propanamide.
What is the SMILES notation for N-[(E)-hex-2-enyl]-2-methyl-N-(2-methylprop-1-enyl)propanamide?
The canonical SMILES for N-[(E)-hex-2-enyl]-2-methyl-N-(2-methylprop-1-enyl)propanamide is CCC/C=C/CN(C=C(C)C)C(=O)C(C)C.
What is the InChIKey of N-[(E)-hex-2-enyl]-2-methyl-N-(2-methylprop-1-enyl)propanamide?
The InChIKey is XVKRCZLHLQBATR-CMDGGOBGSA-N. The full InChI is InChI=1S/C14H25NO/c1-6-7-8-9-10-15(11-12(2)3)14(16)13(4)5/h8-9,11,13H,6-7,10H2,1-5H3/b9-8+.
What are the key properties of N-[(E)-hex-2-enyl]-2-methyl-N-(2-methylprop-1-enyl)propanamide?
N-[(E)-hex-2-enyl]-2-methyl-N-(2-methylprop-1-enyl)propanamide has a molecular weight of 223.36 g/mol, XLogP of 3.75, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-hex-2-enyl]-2-methyl-N-(2-methylprop-1-enyl)propanamide is sourced from PubChem (CID 11775772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).