N-hex-5-en-2-ylacetamide

C8H15NO — CID 12742654

IUPACN-hex-5-en-2-ylacetamide
SMILESC=CCCC(C)NC(C)=O
InChIInChI=1S/C8H15NO/c1-4-5-6-7(2)9-8(3)10/h4,7H,1,5-6H2,2-3H3,(H,9,10)
InChIKeyCTDKMMYWEILNAI-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.48
Rot. Bonds4

About N-hex-5-en-2-ylacetamide

N-hex-5-en-2-ylacetamide (PubChem CID 12742654) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is N-hex-5-en-2-ylacetamide.

Molecular Properties

Compound NameN-hex-5-en-2-ylacetamide
PubChem CID12742654
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC NameN-hex-5-en-2-ylacetamide
SMILESC=CCCC(C)NC(C)=O
InChIInChI=1S/C8H15NO/c1-4-5-6-7(2)9-8(3)10/h4,7H,1,5-6H2,2-3H3,(H,9,10)
InChIKeyCTDKMMYWEILNAI-UHFFFAOYSA-N
XLogP1.48
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
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-hex-5-en-2-ylacetamide 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-(2-cyclohexen-1-yl)acetamide
CID 10219472
N-pent-4-enylacetamide
CID 12444169
N-(Prop-2-en-1-yl)pent-4-enamide
CID 13128362
(5Z)-2-methyl-1,2,3,4,7,8-hexahydroazonin-9-one
CID 23322740
(r,s)-6-Butyl-3,6-dihydro-1h-pyridin-2-one
CID 13616833
N-propylpent-4-enamide
CID 17805708
N-propan-2-ylpent-4-enamide
CID 53840513
N-(pent-4-en-1-yl)prop-2-enamide
CID 53949632
N-hex-5-enylprop-2-enamide
CID 57811140
N-isopropyl-3-butenamide
CID 59532974
N-oct-1-en-3-ylacetamide
CID 87897341
2,2,2-trifluoro-N-pent-4-en-2-ylacetamide
CID 18970201

Frequently Asked Questions

What is the IUPAC name of N-hex-5-en-2-ylacetamide?
The IUPAC name of N-hex-5-en-2-ylacetamide (CID 12742654) is N-hex-5-en-2-ylacetamide.
What is the SMILES notation for N-hex-5-en-2-ylacetamide?
The canonical SMILES for N-hex-5-en-2-ylacetamide is C=CCCC(C)NC(C)=O.
What is the InChIKey of N-hex-5-en-2-ylacetamide?
The InChIKey is CTDKMMYWEILNAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-4-5-6-7(2)9-8(3)10/h4,7H,1,5-6H2,2-3H3,(H,9,10).
What are the key properties of N-hex-5-en-2-ylacetamide?
N-hex-5-en-2-ylacetamide has a molecular weight of 141.21 g/mol, XLogP of 1.48, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-hex-5-en-2-ylacetamide is sourced from PubChem (CID 12742654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).