cyclopent-3-ene-1-carboxamide

C6H9NO — CID 26369821

IUPACcyclopent-3-ene-1-carboxamide
SMILESNC(=O)C1CC=CC1
InChIInChI=1S/C6H9NO/c7-6(8)5-3-1-2-4-5/h1-2,5H,3-4H2,(H2,7,8)
InChIKeyXVPVECZALBQBJX-UHFFFAOYSA-N
MW111.14 g/mol
LogP0.44
Rot. Bonds1

About cyclopent-3-ene-1-carboxamide

cyclopent-3-ene-1-carboxamide (PubChem CID 26369821) has the molecular formula C6H9NO and a molecular weight of 111.14 g/mol. Its IUPAC name is cyclopent-3-ene-1-carboxamide.

Molecular Properties

Compound Namecyclopent-3-ene-1-carboxamide
PubChem CID26369821
Molecular FormulaC6H9NO
Molecular Weight111.14 g/mol
Exact Mass111.07
IUPAC Namecyclopent-3-ene-1-carboxamide
SMILESNC(=O)C1CC=CC1
InChIInChI=1S/C6H9NO/c7-6(8)5-3-1-2-4-5/h1-2,5H,3-4H2,(H2,7,8)
InChIKeyXVPVECZALBQBJX-UHFFFAOYSA-N
XLogP0.44
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.14
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-Cyclohexene-1-carboxamide
CID 301015
4-Pentenamide, 2-(2-propen-1-yl)-
CID 181288
2-(Cyclopent-2-en-1-yl)acetamide
CID 247160
2-Cyclobutene-1-carboxamide
CID 543065
Dihydrobenzoylamine
CID 18942709
Hept-5-ene-2-carboxamide
CID 21660794
(1S)-cyclohex-3-ene-1-carboxamide
CID 51410670
(E,2S)-N-fluoro-2-methylnon-4-enamide
CID 153438473
2-Cyclopentene-1-carboxamide
CID 303547
Cyclopent-3-enecarbohydroximic acid
CID 129651391
7-Methyloct-4-enoic amide
CID 129735237
2-Cyclohexa-2,4-dien-1-ylacetamide
CID 20475026

Frequently Asked Questions

What is the IUPAC name of cyclopent-3-ene-1-carboxamide?
The IUPAC name of cyclopent-3-ene-1-carboxamide (CID 26369821) is cyclopent-3-ene-1-carboxamide.
What is the SMILES notation for cyclopent-3-ene-1-carboxamide?
The canonical SMILES for cyclopent-3-ene-1-carboxamide is NC(=O)C1CC=CC1.
What is the InChIKey of cyclopent-3-ene-1-carboxamide?
The InChIKey is XVPVECZALBQBJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO/c7-6(8)5-3-1-2-4-5/h1-2,5H,3-4H2,(H2,7,8).
What are the key properties of cyclopent-3-ene-1-carboxamide?
cyclopent-3-ene-1-carboxamide has a molecular weight of 111.14 g/mol, XLogP of 0.44, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopent-3-ene-1-carboxamide is sourced from PubChem (CID 26369821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).