N-cyclohex-2-en-1-ylpyrrolidine-2-carboxamide

C11H18N2O — CID 130689559

IUPACN-cyclohex-2-en-1-ylpyrrolidine-2-carboxamide
SMILESO=C(NC1C=CCCC1)C1CCCN1
InChIInChI=1S/C11H18N2O/c14-11(10-7-4-8-12-10)13-9-5-2-1-3-6-9/h2,5,9-10,12H,1,3-4,6-8H2,(H,13,14)
InChIKeyDNRMCKOFIAPXJH-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.96
Rot. Bonds2

About N-cyclohex-2-en-1-ylpyrrolidine-2-carboxamide

N-cyclohex-2-en-1-ylpyrrolidine-2-carboxamide (PubChem CID 130689559) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is N-cyclohex-2-en-1-ylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-cyclohex-2-en-1-ylpyrrolidine-2-carboxamide
PubChem CID130689559
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC NameN-cyclohex-2-en-1-ylpyrrolidine-2-carboxamide
SMILESO=C(NC1C=CCCC1)C1CCCN1
InChIInChI=1S/C11H18N2O/c14-11(10-7-4-8-12-10)13-9-5-2-1-3-6-9/h2,5,9-10,12H,1,3-4,6-8H2,(H,13,14)
InChIKeyDNRMCKOFIAPXJH-UHFFFAOYSA-N
XLogP0.96
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-cyclohex-2-en-1-ylpyrrolidine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,6-Diamino-1-(3,6-dihydro-2H-pyridin-1-yl)-hexan-1-one
CID 44364231
N-[(E)-8-amino-2-methyl-8-oxooct-5-en-4-yl]-5-oxopyrrolidine-2-carboxamide
CID 44386090
N-[(4-fluorocyclohex-3-en-1-yl)methyl]pyrrolidine-2-carboxamide
CID 172877858
N-(prop-2-en-1-yl)pyrrolidine-2-carboxamide
CID 24710865
N-[(6-fluoro-5-methylcyclohexa-1,5-dien-1-yl)methyl]pyrrolidine-2-carboxamide
CID 144912267
N-[(2Z)-3-fluoro-4-methyl-2-[(Z)-prop-1-enyl]penta-2,4-dienyl]pyrrolidine-2-carboxamide
CID 153350983
N-(3-bromo-2-fluorocyclohexa-2,4-dien-1-yl)pyrrolidine-2-carboxamide
CID 166778588
(2S)-1-[(1R)-cyclohex-2-en-1-yl]-N-hydroxypyrrolidine-2-carboxamide
CID 122372183
(2S)-1-[(1S)-cyclohex-2-en-1-yl]pyrrolidine-2-carboxamide
CID 122372184
(2S)-1-[(1R)-cyclohex-2-en-1-yl]pyrrolidine-2-carboxamide
CID 122372186
(2S)-1-[(1S)-cyclohex-2-en-1-yl]-N-hydroxypyrrolidine-2-carboxamide
CID 122372189
(2S)-1-cyclohex-2-en-1-yl-N-hydroxypyrrolidine-2-carboxamide
CID 139247449

Frequently Asked Questions

What is the IUPAC name of N-cyclohex-2-en-1-ylpyrrolidine-2-carboxamide?
The IUPAC name of N-cyclohex-2-en-1-ylpyrrolidine-2-carboxamide (CID 130689559) is N-cyclohex-2-en-1-ylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-cyclohex-2-en-1-ylpyrrolidine-2-carboxamide?
The canonical SMILES for N-cyclohex-2-en-1-ylpyrrolidine-2-carboxamide is O=C(NC1C=CCCC1)C1CCCN1.
What is the InChIKey of N-cyclohex-2-en-1-ylpyrrolidine-2-carboxamide?
The InChIKey is DNRMCKOFIAPXJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c14-11(10-7-4-8-12-10)13-9-5-2-1-3-6-9/h2,5,9-10,12H,1,3-4,6-8H2,(H,13,14).
What are the key properties of N-cyclohex-2-en-1-ylpyrrolidine-2-carboxamide?
N-cyclohex-2-en-1-ylpyrrolidine-2-carboxamide has a molecular weight of 194.28 g/mol, XLogP of 0.96, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohex-2-en-1-ylpyrrolidine-2-carboxamide is sourced from PubChem (CID 130689559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).