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

C12H19NO — CID 832625

IUPACN-[2-(cyclohexen-1-yl)ethyl]cyclopropanecarboxamide
SMILESO=C(NCCC1=CCCCC1)C1CC1
InChIInChI=1S/C12H19NO/c14-12(11-6-7-11)13-9-8-10-4-2-1-3-5-10/h4,11H,1-3,5-9H2,(H,13,14)
InChIKeyZCCSZIUSYSKPMV-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.40
Rot. Bonds4

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

N-[2-(cyclohexen-1-yl)ethyl]cyclopropanecarboxamide (PubChem CID 832625) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is N-[2-(cyclohexen-1-yl)ethyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[2-(cyclohexen-1-yl)ethyl]cyclopropanecarboxamide
PubChem CID832625
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC NameN-[2-(cyclohexen-1-yl)ethyl]cyclopropanecarboxamide
SMILESO=C(NCCC1=CCCCC1)C1CC1
InChIInChI=1S/C12H19NO/c14-12(11-6-7-11)13-9-8-10-4-2-1-3-5-10/h4,11H,1-3,5-9H2,(H,13,14)
InChIKeyZCCSZIUSYSKPMV-UHFFFAOYSA-N
XLogP2.40
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.40
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]cyclopropanecarboxamide?
The IUPAC name of N-[2-(cyclohexen-1-yl)ethyl]cyclopropanecarboxamide (CID 832625) is N-[2-(cyclohexen-1-yl)ethyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[2-(cyclohexen-1-yl)ethyl]cyclopropanecarboxamide?
The canonical SMILES for N-[2-(cyclohexen-1-yl)ethyl]cyclopropanecarboxamide is O=C(NCCC1=CCCCC1)C1CC1.
What is the InChIKey of N-[2-(cyclohexen-1-yl)ethyl]cyclopropanecarboxamide?
The InChIKey is ZCCSZIUSYSKPMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c14-12(11-6-7-11)13-9-8-10-4-2-1-3-5-10/h4,11H,1-3,5-9H2,(H,13,14).
What are the key properties of N-[2-(cyclohexen-1-yl)ethyl]cyclopropanecarboxamide?
N-[2-(cyclohexen-1-yl)ethyl]cyclopropanecarboxamide has a molecular weight of 193.29 g/mol, XLogP of 2.40, 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]cyclopropanecarboxamide is sourced from PubChem (CID 832625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).