2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(2-methylpropyl)acetamide

C14H23NO — CID 78850541

IUPAC2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(2-methylpropyl)acetamide
SMILESCC(C)CN(C(=O)CC1C=CCC1)C1CC1
InChIInChI=1S/C14H23NO/c1-11(2)10-15(13-7-8-13)14(16)9-12-5-3-4-6-12/h3,5,11-13H,4,6-10H2,1-2H3
InChIKeyKVZXIHJKKZKAAK-UHFFFAOYSA-N
MW221.34 g/mol
LogP2.99
Rot. Bonds5

About 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(2-methylpropyl)acetamide

2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(2-methylpropyl)acetamide (PubChem CID 78850541) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(2-methylpropyl)acetamide.

Molecular Properties

Compound Name2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(2-methylpropyl)acetamide
PubChem CID78850541
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(2-methylpropyl)acetamide
SMILESCC(C)CN(C(=O)CC1C=CCC1)C1CC1
InChIInChI=1S/C14H23NO/c1-11(2)10-15(13-7-8-13)14(16)9-12-5-3-4-6-12/h3,5,11-13H,4,6-10H2,1-2H3
InChIKeyKVZXIHJKKZKAAK-UHFFFAOYSA-N
XLogP2.99
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 52.99
H-Bond Donors ≤ 50
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 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(2-methylpropyl)acetamide?
The IUPAC name of 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(2-methylpropyl)acetamide (CID 78850541) is 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(2-methylpropyl)acetamide.
What is the SMILES notation for 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(2-methylpropyl)acetamide?
The canonical SMILES for 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(2-methylpropyl)acetamide is CC(C)CN(C(=O)CC1C=CCC1)C1CC1.
What is the InChIKey of 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(2-methylpropyl)acetamide?
The InChIKey is KVZXIHJKKZKAAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-11(2)10-15(13-7-8-13)14(16)9-12-5-3-4-6-12/h3,5,11-13H,4,6-10H2,1-2H3.
What are the key properties of 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(2-methylpropyl)acetamide?
2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(2-methylpropyl)acetamide has a molecular weight of 221.34 g/mol, XLogP of 2.99, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(2-methylpropyl)acetamide is sourced from PubChem (CID 78850541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).