3-[1-(cyclohexene-1-carbonyl)piperidin-4-yl]-N-cyclopropylpropanamide

C18H28N2O2 — CID 26402973

IUPAC3-[1-(cyclohexene-1-carbonyl)piperidin-4-yl]-N-cyclopropylpropanamide
SMILESO=C(CCC1CCN(C(=O)C2=CCCCC2)CC1)NC1CC1
InChIInChI=1S/C18H28N2O2/c21-17(19-16-7-8-16)9-6-14-10-12-20(13-11-14)18(22)15-4-2-1-3-5-15/h4,14,16H,1-3,5-13H2,(H,19,21)
InChIKeyWAQTUTWLHYNGSV-UHFFFAOYSA-N
MW304.43 g/mol
LogP2.78
Rot. Bonds5

About 3-[1-(cyclohexene-1-carbonyl)piperidin-4-yl]-N-cyclopropylpropanamide

3-[1-(cyclohexene-1-carbonyl)piperidin-4-yl]-N-cyclopropylpropanamide (PubChem CID 26402973) has the molecular formula C18H28N2O2 and a molecular weight of 304.43 g/mol. Its IUPAC name is 3-[1-(cyclohexene-1-carbonyl)piperidin-4-yl]-N-cyclopropylpropanamide.

Molecular Properties

Compound Name3-[1-(cyclohexene-1-carbonyl)piperidin-4-yl]-N-cyclopropylpropanamide
PubChem CID26402973
Molecular FormulaC18H28N2O2
Molecular Weight304.43 g/mol
Exact Mass304.22
IUPAC Name3-[1-(cyclohexene-1-carbonyl)piperidin-4-yl]-N-cyclopropylpropanamide
SMILESO=C(CCC1CCN(C(=O)C2=CCCCC2)CC1)NC1CC1
InChIInChI=1S/C18H28N2O2/c21-17(19-16-7-8-16)9-6-14-10-12-20(13-11-14)18(22)15-4-2-1-3-5-15/h4,14,16H,1-3,5-13H2,(H,19,21)
InChIKeyWAQTUTWLHYNGSV-UHFFFAOYSA-N
XLogP2.78
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.43
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[1-(cyclohexene-1-carbonyl)piperidin-4-yl]-N-cyclopropylpropanamide?
The IUPAC name of 3-[1-(cyclohexene-1-carbonyl)piperidin-4-yl]-N-cyclopropylpropanamide (CID 26402973) is 3-[1-(cyclohexene-1-carbonyl)piperidin-4-yl]-N-cyclopropylpropanamide.
What is the SMILES notation for 3-[1-(cyclohexene-1-carbonyl)piperidin-4-yl]-N-cyclopropylpropanamide?
The canonical SMILES for 3-[1-(cyclohexene-1-carbonyl)piperidin-4-yl]-N-cyclopropylpropanamide is O=C(CCC1CCN(C(=O)C2=CCCCC2)CC1)NC1CC1.
What is the InChIKey of 3-[1-(cyclohexene-1-carbonyl)piperidin-4-yl]-N-cyclopropylpropanamide?
The InChIKey is WAQTUTWLHYNGSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O2/c21-17(19-16-7-8-16)9-6-14-10-12-20(13-11-14)18(22)15-4-2-1-3-5-15/h4,14,16H,1-3,5-13H2,(H,19,21).
What are the key properties of 3-[1-(cyclohexene-1-carbonyl)piperidin-4-yl]-N-cyclopropylpropanamide?
3-[1-(cyclohexene-1-carbonyl)piperidin-4-yl]-N-cyclopropylpropanamide has a molecular weight of 304.43 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(cyclohexene-1-carbonyl)piperidin-4-yl]-N-cyclopropylpropanamide is sourced from PubChem (CID 26402973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).