N-cyclohex-2-en-1-ylacetamide

C8H13NO — CID 10219472

IUPACN-cyclohex-2-en-1-ylacetamide
SMILESCC(=O)NC1C=CCCC1
InChIInChI=1S/C8H13NO/c1-7(10)9-8-5-3-2-4-6-8/h3,5,8H,2,4,6H2,1H3,(H,9,10)
InChIKeyZYVQVLHBHMJVEO-UHFFFAOYSA-N
MW139.20 g/mol
LogP1.23
Rot. Bonds1

About N-cyclohex-2-en-1-ylacetamide

N-cyclohex-2-en-1-ylacetamide (PubChem CID 10219472) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is N-cyclohex-2-en-1-ylacetamide.

Molecular Properties

Compound NameN-cyclohex-2-en-1-ylacetamide
PubChem CID10219472
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC NameN-cyclohex-2-en-1-ylacetamide
SMILESCC(=O)NC1C=CCCC1
InChIInChI=1S/C8H13NO/c1-7(10)9-8-5-3-2-4-6-8/h3,5,8H,2,4,6H2,1H3,(H,9,10)
InChIKeyZYVQVLHBHMJVEO-UHFFFAOYSA-N
XLogP1.23
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-cyclohex-2-en-1-ylacetamide?
The IUPAC name of N-cyclohex-2-en-1-ylacetamide (CID 10219472) is N-cyclohex-2-en-1-ylacetamide.
What is the SMILES notation for N-cyclohex-2-en-1-ylacetamide?
The canonical SMILES for N-cyclohex-2-en-1-ylacetamide is CC(=O)NC1C=CCCC1.
What is the InChIKey of N-cyclohex-2-en-1-ylacetamide?
The InChIKey is ZYVQVLHBHMJVEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO/c1-7(10)9-8-5-3-2-4-6-8/h3,5,8H,2,4,6H2,1H3,(H,9,10).
What are the key properties of N-cyclohex-2-en-1-ylacetamide?
N-cyclohex-2-en-1-ylacetamide has a molecular weight of 139.20 g/mol, XLogP of 1.23, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohex-2-en-1-ylacetamide is sourced from PubChem (CID 10219472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).