N-[2-(cyclohexen-1-yl)ethyl]cyclopentanecarboxamide

C14H23NO — CID 896209

IUPACN-[2-(cyclohexen-1-yl)ethyl]cyclopentanecarboxamide
SMILESO=C(NCCC1=CCCCC1)C1CCCC1
InChIInChI=1S/C14H23NO/c16-14(13-8-4-5-9-13)15-11-10-12-6-2-1-3-7-12/h6,13H,1-5,7-11H2,(H,15,16)
InChIKeyJFDXDZXPIHXDPH-UHFFFAOYSA-N
MW221.34 g/mol
LogP3.18
Rot. Bonds4

About N-[2-(cyclohexen-1-yl)ethyl]cyclopentanecarboxamide

N-[2-(cyclohexen-1-yl)ethyl]cyclopentanecarboxamide (PubChem CID 896209) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is N-[2-(cyclohexen-1-yl)ethyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[2-(cyclohexen-1-yl)ethyl]cyclopentanecarboxamide
PubChem CID896209
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC NameN-[2-(cyclohexen-1-yl)ethyl]cyclopentanecarboxamide
SMILESO=C(NCCC1=CCCCC1)C1CCCC1
InChIInChI=1S/C14H23NO/c16-14(13-8-4-5-9-13)15-11-10-12-6-2-1-3-7-12/h6,13H,1-5,7-11H2,(H,15,16)
InChIKeyJFDXDZXPIHXDPH-UHFFFAOYSA-N
XLogP3.18
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 53.18
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-[2-(cyclohexen-1-yl)ethyl]cyclopentanecarboxamide?
The IUPAC name of N-[2-(cyclohexen-1-yl)ethyl]cyclopentanecarboxamide (CID 896209) is N-[2-(cyclohexen-1-yl)ethyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[2-(cyclohexen-1-yl)ethyl]cyclopentanecarboxamide?
The canonical SMILES for N-[2-(cyclohexen-1-yl)ethyl]cyclopentanecarboxamide is O=C(NCCC1=CCCCC1)C1CCCC1.
What is the InChIKey of N-[2-(cyclohexen-1-yl)ethyl]cyclopentanecarboxamide?
The InChIKey is JFDXDZXPIHXDPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c16-14(13-8-4-5-9-13)15-11-10-12-6-2-1-3-7-12/h6,13H,1-5,7-11H2,(H,15,16).
What are the key properties of N-[2-(cyclohexen-1-yl)ethyl]cyclopentanecarboxamide?
N-[2-(cyclohexen-1-yl)ethyl]cyclopentanecarboxamide has a molecular weight of 221.34 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclohexen-1-yl)ethyl]cyclopentanecarboxamide is sourced from PubChem (CID 896209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).