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

C11H18N2O — CID 12274570

IUPACN-cyclohex-2-en-1-ylpyrrolidine-1-carboxamide
SMILESC1CCN(C1)C(=O)NC2CCCC=C2
InChIInChI=1S/C11H18N2O/c14-11(13-8-4-5-9-13)12-10-6-2-1-3-7-10/h2,6,10H,1,3-5,7-9H2,(H,12,14)
InChIKeyQYBKCDWWKIVPDO-UHFFFAOYSA-N
MW194.27 g/mol
LogP1.50
Rot. Bonds1

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

N-cyclohex-2-en-1-ylpyrrolidine-1-carboxamide (PubChem CID 12274570) has the molecular formula C11H18N2O and a molecular weight of 194.27 g/mol. Its IUPAC name is N-cyclohex-2-en-1-ylpyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclohex-2-en-1-ylpyrrolidine-1-carboxamide
PubChem CID12274570
Molecular FormulaC11H18N2O
Molecular Weight194.27 g/mol
Exact Mass194.14
IUPAC NameN-cyclohex-2-en-1-ylpyrrolidine-1-carboxamide
SMILESC1CCN(C1)C(=O)NC2CCCC=C2
InChIInChI=1S/C11H18N2O/c14-11(13-8-4-5-9-13)12-10-6-2-1-3-7-10/h2,6,10H,1,3-5,7-9H2,(H,12,14)
InChIKeyQYBKCDWWKIVPDO-UHFFFAOYSA-N
XLogP1.50
TPSA32.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity231

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.27
LogP ≤ 51.50
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-Cyclohex-2-en-1-yl-1,1-dimethylurea
CID 15112130
1-Cyclohex-2-en-1-yl-3-(2-fluoroethyl)urea
CID 280779
N-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]oct-2-ene-8-carboxamide
CID 163284782
1,3,3a,4,7,7a-Hexahydrobenzimidazol-2-one
CID 22268054
N-[(2E)-3,7-dimethylocta-2,6-dienyl]pyrrolidine-1-carboxamide
CID 12274568
1-Cyclohex-2-en-1-yl-3-methylimidazolidin-2-one
CID 101501273
1,1-dimethyl-3-[(E)-non-5-en-4-yl]urea
CID 134989520
3-[(E)-hept-2-en-4-yl]-1,1-dimethylurea
CID 134989608
N-cyclohex-2-en-1-yl-3-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]pyrrolidine-1-carboxamide
CID 86800454
(3S)-N-[(1S)-cyclohex-2-en-1-yl]-3-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]pyrrolidine-1-carboxamide
CID 99856345
(3R)-N-[(1S)-cyclohex-2-en-1-yl]-3-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]pyrrolidine-1-carboxamide
CID 99856346
(3S)-N-[(1R)-cyclohex-2-en-1-yl]-3-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]pyrrolidine-1-carboxamide
CID 129374045

Frequently Asked Questions

What is the IUPAC name of N-cyclohex-2-en-1-ylpyrrolidine-1-carboxamide?
The IUPAC name of N-cyclohex-2-en-1-ylpyrrolidine-1-carboxamide (CID 12274570) is N-cyclohex-2-en-1-ylpyrrolidine-1-carboxamide.
What is the SMILES notation for N-cyclohex-2-en-1-ylpyrrolidine-1-carboxamide?
The canonical SMILES for N-cyclohex-2-en-1-ylpyrrolidine-1-carboxamide is C1CCN(C1)C(=O)NC2CCCC=C2.
What is the InChIKey of N-cyclohex-2-en-1-ylpyrrolidine-1-carboxamide?
The InChIKey is QYBKCDWWKIVPDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c14-11(13-8-4-5-9-13)12-10-6-2-1-3-7-10/h2,6,10H,1,3-5,7-9H2,(H,12,14).
What are the key properties of N-cyclohex-2-en-1-ylpyrrolidine-1-carboxamide?
N-cyclohex-2-en-1-ylpyrrolidine-1-carboxamide has a molecular weight of 194.27 g/mol, XLogP of 1.50, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohex-2-en-1-ylpyrrolidine-1-carboxamide is sourced from PubChem (CID 12274570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).