6-acetyl-N-(2-pyrrolidin-1-ylethyl)cyclohexene-1-carboxamide

C15H24N2O2 — CID 167103927

IUPAC6-acetyl-N-(2-pyrrolidin-1-ylethyl)cyclohexene-1-carboxamide
SMILESCC(=O)C1CCCC=C1C(=O)NCCN1CCCC1
InChIInChI=1S/C15H24N2O2/c1-12(18)13-6-2-3-7-14(13)15(19)16-8-11-17-9-4-5-10-17/h7,13H,2-6,8-11H2,1H3,(H,16,19)
InChIKeyQUXREGYTYYHDCN-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.51
Rot. Bonds5

About 6-acetyl-N-(2-pyrrolidin-1-ylethyl)cyclohexene-1-carboxamide

6-acetyl-N-(2-pyrrolidin-1-ylethyl)cyclohexene-1-carboxamide (PubChem CID 167103927) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 6-acetyl-N-(2-pyrrolidin-1-ylethyl)cyclohexene-1-carboxamide.

Molecular Properties

Compound Name6-acetyl-N-(2-pyrrolidin-1-ylethyl)cyclohexene-1-carboxamide
PubChem CID167103927
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name6-acetyl-N-(2-pyrrolidin-1-ylethyl)cyclohexene-1-carboxamide
SMILESCC(=O)C1CCCC=C1C(=O)NCCN1CCCC1
InChIInChI=1S/C15H24N2O2/c1-12(18)13-6-2-3-7-14(13)15(19)16-8-11-17-9-4-5-10-17/h7,13H,2-6,8-11H2,1H3,(H,16,19)
InChIKeyQUXREGYTYYHDCN-UHFFFAOYSA-N
XLogP1.51
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-N-(2-piperidin-1-ylethyl)cyclohexa-1,5-diene-1-carboxamide
CID 173159505
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CID 123586173
3-methyl-N-(2-piperidin-1-ylethyl)benzamide;hydrochloride
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2-methyl-N-(2-piperidin-1-ylethyl)-1H-imidazole-5-carboxamide
CID 138993912
4-(methylamino)-N-(2-piperidin-1-ylethyl)benzamide
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3,4-dimethyl-N-(2-piperidin-1-ylethyl)benzamide
CID 25237097
N-[2-(azepan-1-yl)ethyl]-2-bromo-5-methylbenzamide
CID 80979640
1,2,5-trimethyl-N-(2-piperidin-1-ylethyl)pyrrole-3-carboxamide
CID 125144865
2-(2-pyrrolidin-1-ylethylcarbamoyl)benzoic acid;hydrate
CID 21152769
2-chloro-N-(2-pyrrolidin-1-ylethyl)benzamide;hydrochloride
CID 2941366
5-methyl-N-(2-piperidin-1-ylethyl)-1H-indazole-3-carboxamide
CID 78878733
2-(methylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide
CID 55211981

Frequently Asked Questions

What is the IUPAC name of 6-acetyl-N-(2-pyrrolidin-1-ylethyl)cyclohexene-1-carboxamide?
The IUPAC name of 6-acetyl-N-(2-pyrrolidin-1-ylethyl)cyclohexene-1-carboxamide (CID 167103927) is 6-acetyl-N-(2-pyrrolidin-1-ylethyl)cyclohexene-1-carboxamide.
What is the SMILES notation for 6-acetyl-N-(2-pyrrolidin-1-ylethyl)cyclohexene-1-carboxamide?
The canonical SMILES for 6-acetyl-N-(2-pyrrolidin-1-ylethyl)cyclohexene-1-carboxamide is CC(=O)C1CCCC=C1C(=O)NCCN1CCCC1.
What is the InChIKey of 6-acetyl-N-(2-pyrrolidin-1-ylethyl)cyclohexene-1-carboxamide?
The InChIKey is QUXREGYTYYHDCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-12(18)13-6-2-3-7-14(13)15(19)16-8-11-17-9-4-5-10-17/h7,13H,2-6,8-11H2,1H3,(H,16,19).
What are the key properties of 6-acetyl-N-(2-pyrrolidin-1-ylethyl)cyclohexene-1-carboxamide?
6-acetyl-N-(2-pyrrolidin-1-ylethyl)cyclohexene-1-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 1.51, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-acetyl-N-(2-pyrrolidin-1-ylethyl)cyclohexene-1-carboxamide is sourced from PubChem (CID 167103927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).