N-hex-5-enylacetamide

C8H15NO — CID 10877209

IUPACN-hex-5-enylacetamide
SMILESC=CCCCCNC(C)=O
InChIInChI=1S/C8H15NO/c1-3-4-5-6-7-9-8(2)10/h3H,1,4-7H2,2H3,(H,9,10)
InChIKeyXDYNPXNYXKIWKP-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.48
Rot. Bonds5

About N-hex-5-enylacetamide

N-hex-5-enylacetamide (PubChem CID 10877209) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is N-hex-5-enylacetamide.

Molecular Properties

Compound NameN-hex-5-enylacetamide
PubChem CID10877209
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC NameN-hex-5-enylacetamide
SMILESC=CCCCCNC(C)=O
InChIInChI=1S/C8H15NO/c1-3-4-5-6-7-9-8(2)10/h3H,1,4-7H2,2H3,(H,9,10)
InChIKeyXDYNPXNYXKIWKP-UHFFFAOYSA-N
XLogP1.48
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
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': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-hex-5-enylacetamide?
The IUPAC name of N-hex-5-enylacetamide (CID 10877209) is N-hex-5-enylacetamide.
What is the SMILES notation for N-hex-5-enylacetamide?
The canonical SMILES for N-hex-5-enylacetamide is C=CCCCCNC(C)=O.
What is the InChIKey of N-hex-5-enylacetamide?
The InChIKey is XDYNPXNYXKIWKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-3-4-5-6-7-9-8(2)10/h3H,1,4-7H2,2H3,(H,9,10).
What are the key properties of N-hex-5-enylacetamide?
N-hex-5-enylacetamide has a molecular weight of 141.21 g/mol, XLogP of 1.48, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-hex-5-enylacetamide is sourced from PubChem (CID 10877209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).