N-(2-methylpent-4-en-2-yl)acetamide

C8H15NO — CID 54506762

IUPACN-(2-methylpent-4-en-2-yl)acetamide
SMILESC=CCC(C)(C)NC(C)=O
InChIInChI=1S/C8H15NO/c1-5-6-8(3,4)9-7(2)10/h5H,1,6H2,2-4H3,(H,9,10)
InChIKeyYGGSRDNQRINBNY-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.48
Rot. Bonds3

About N-(2-methylpent-4-en-2-yl)acetamide

N-(2-methylpent-4-en-2-yl)acetamide (PubChem CID 54506762) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is N-(2-methylpent-4-en-2-yl)acetamide.

Molecular Properties

Compound NameN-(2-methylpent-4-en-2-yl)acetamide
PubChem CID54506762
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC NameN-(2-methylpent-4-en-2-yl)acetamide
SMILESC=CCC(C)(C)NC(C)=O
InChIInChI=1S/C8H15NO/c1-5-6-8(3,4)9-7(2)10/h5H,1,6H2,2-4H3,(H,9,10)
InChIKeyYGGSRDNQRINBNY-UHFFFAOYSA-N
XLogP1.48
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-(2-methylpent-4-en-2-yl)acetamide 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-(6-acetamido-2,6-dimethyl-4-oxoheptan-2-yl)acetamide
CID 139120888
ethane;N-(2-methylbutan-2-yl)acetamide
CID 142252022
(2Z)-3,4,4-trimethylhepta-2,6-dienoic acid
CID 90303605
N-(5-amino-2-methylpentan-2-yl)acetamide
CID 131222896
N-[1-(dimethylamino)-2-methylpropan-2-yl]acetamide;ethane
CID 145224107
2-[2-(methoxymethyl)phenyl]-N-(2-methylpent-4-en-2-yl)acetamide
CID 166301631
N-[(4E)-4-(hydroxymethylidene)-2-methylhexan-2-yl]acetamide
CID 130412607
N-(2,4-dimethyl-5-oxohexan-2-yl)acetamide
CID 153336695
N-(2,3-dimethylpent-4-en-2-yl)acetamide
CID 143357201
N-(2,4-dimethyl-4-methylsulfanylpentan-2-yl)acetamide
CID 166829740
N-(2,4,4,5-tetramethylhexan-2-yl)acetamide
CID 142527857
2-methyl-N-(2-methylbutan-2-yl)pent-4-en-2-amine
CID 142811014

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpent-4-en-2-yl)acetamide?
The IUPAC name of N-(2-methylpent-4-en-2-yl)acetamide (CID 54506762) is N-(2-methylpent-4-en-2-yl)acetamide.
What is the SMILES notation for N-(2-methylpent-4-en-2-yl)acetamide?
The canonical SMILES for N-(2-methylpent-4-en-2-yl)acetamide is C=CCC(C)(C)NC(C)=O.
What is the InChIKey of N-(2-methylpent-4-en-2-yl)acetamide?
The InChIKey is YGGSRDNQRINBNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-5-6-8(3,4)9-7(2)10/h5H,1,6H2,2-4H3,(H,9,10).
What are the key properties of N-(2-methylpent-4-en-2-yl)acetamide?
N-(2-methylpent-4-en-2-yl)acetamide has a molecular weight of 141.21 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpent-4-en-2-yl)acetamide is sourced from PubChem (CID 54506762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).