N-ethylcyclopent-3-ene-1-carboxamide

C8H13NO — CID 45084076

IUPACN-ethylcyclopent-3-ene-1-carboxamide
SMILESCCNC(=O)C1CC=CC1
InChIInChI=1S/C8H13NO/c1-2-9-8(10)7-5-3-4-6-7/h3-4,7H,2,5-6H2,1H3,(H,9,10)
InChIKeyMEDUHLFEUBSDDB-UHFFFAOYSA-N
MW139.20 g/mol
LogP1.09
Rot. Bonds2

About N-ethylcyclopent-3-ene-1-carboxamide

N-ethylcyclopent-3-ene-1-carboxamide (PubChem CID 45084076) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is N-ethylcyclopent-3-ene-1-carboxamide.

Molecular Properties

Compound NameN-ethylcyclopent-3-ene-1-carboxamide
PubChem CID45084076
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC NameN-ethylcyclopent-3-ene-1-carboxamide
SMILESCCNC(=O)C1CC=CC1
InChIInChI=1S/C8H13NO/c1-2-9-8(10)7-5-3-4-6-7/h3-4,7H,2,5-6H2,1H3,(H,9,10)
InChIKeyMEDUHLFEUBSDDB-UHFFFAOYSA-N
XLogP1.09
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.09
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-ethylcyclopent-3-ene-1-carboxamide?
The IUPAC name of N-ethylcyclopent-3-ene-1-carboxamide (CID 45084076) is N-ethylcyclopent-3-ene-1-carboxamide.
What is the SMILES notation for N-ethylcyclopent-3-ene-1-carboxamide?
The canonical SMILES for N-ethylcyclopent-3-ene-1-carboxamide is CCNC(=O)C1CC=CC1.
What is the InChIKey of N-ethylcyclopent-3-ene-1-carboxamide?
The InChIKey is MEDUHLFEUBSDDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO/c1-2-9-8(10)7-5-3-4-6-7/h3-4,7H,2,5-6H2,1H3,(H,9,10).
What are the key properties of N-ethylcyclopent-3-ene-1-carboxamide?
N-ethylcyclopent-3-ene-1-carboxamide has a molecular weight of 139.20 g/mol, XLogP of 1.09, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylcyclopent-3-ene-1-carboxamide is sourced from PubChem (CID 45084076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).