N-[(E)-hex-1-enyl]acetamide

C8H15NO — CID 55288374

IUPACN-[(E)-hex-1-enyl]acetamide
SMILESCCCC/C=C/NC(C)=O
InChIInChI=1S/C8H15NO/c1-3-4-5-6-7-9-8(2)10/h6-7H,3-5H2,1-2H3,(H,9,10)/b7-6+
InChIKeyFKPDSVXLAARYIA-VOTSOKGWSA-N
MW141.21 g/mol
LogP1.83
Rot. Bonds4

About N-[(E)-hex-1-enyl]acetamide

N-[(E)-hex-1-enyl]acetamide (PubChem CID 55288374) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is N-[(E)-hex-1-enyl]acetamide.

Molecular Properties

Compound NameN-[(E)-hex-1-enyl]acetamide
PubChem CID55288374
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC NameN-[(E)-hex-1-enyl]acetamide
SMILESCCCC/C=C/NC(C)=O
InChIInChI=1S/C8H15NO/c1-3-4-5-6-7-9-8(2)10/h6-7H,3-5H2,1-2H3,(H,9,10)/b7-6+
InChIKeyFKPDSVXLAARYIA-VOTSOKGWSA-N
XLogP1.83
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 ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[(E)-hex-1-enyl]acetamide?
The IUPAC name of N-[(E)-hex-1-enyl]acetamide (CID 55288374) is N-[(E)-hex-1-enyl]acetamide.
What is the SMILES notation for N-[(E)-hex-1-enyl]acetamide?
The canonical SMILES for N-[(E)-hex-1-enyl]acetamide is CCCC/C=C/NC(C)=O.
What is the InChIKey of N-[(E)-hex-1-enyl]acetamide?
The InChIKey is FKPDSVXLAARYIA-VOTSOKGWSA-N. The full InChI is InChI=1S/C8H15NO/c1-3-4-5-6-7-9-8(2)10/h6-7H,3-5H2,1-2H3,(H,9,10)/b7-6+.
What are the key properties of N-[(E)-hex-1-enyl]acetamide?
N-[(E)-hex-1-enyl]acetamide has a molecular weight of 141.21 g/mol, XLogP of 1.83, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-hex-1-enyl]acetamide is sourced from PubChem (CID 55288374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).