3-piperidin-4-yl-N-(4-propylcyclohexyl)butanamide

C18H34N2O — CID 119750393

IUPAC3-piperidin-4-yl-N-(4-propylcyclohexyl)butanamide
SMILESCCCC1CCC(NC(=O)CC(C)C2CCNCC2)CC1
InChIInChI=1S/C18H34N2O/c1-3-4-15-5-7-17(8-6-15)20-18(21)13-14(2)16-9-11-19-12-10-16/h14-17,19H,3-13H2,1-2H3,(H,20,21)
InChIKeyXJMGKZKNHHOANQ-UHFFFAOYSA-N
MW294.48 g/mol
LogP3.49
Rot. Bonds6

About 3-piperidin-4-yl-N-(4-propylcyclohexyl)butanamide

3-piperidin-4-yl-N-(4-propylcyclohexyl)butanamide (PubChem CID 119750393) has the molecular formula C18H34N2O and a molecular weight of 294.48 g/mol. Its IUPAC name is 3-piperidin-4-yl-N-(4-propylcyclohexyl)butanamide.

Molecular Properties

Compound Name3-piperidin-4-yl-N-(4-propylcyclohexyl)butanamide
PubChem CID119750393
Molecular FormulaC18H34N2O
Molecular Weight294.48 g/mol
Exact Mass294.27
IUPAC Name3-piperidin-4-yl-N-(4-propylcyclohexyl)butanamide
SMILESCCCC1CCC(NC(=O)CC(C)C2CCNCC2)CC1
InChIInChI=1S/C18H34N2O/c1-3-4-15-5-7-17(8-6-15)20-18(21)13-14(2)16-9-11-19-12-10-16/h14-17,19H,3-13H2,1-2H3,(H,20,21)
InChIKeyXJMGKZKNHHOANQ-UHFFFAOYSA-N
XLogP3.49
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.48
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclobutyl-3-piperidin-4-ylbutanamide;hydrochloride
CID 119726928
N-(2-methylpentan-2-yl)-3-piperidin-4-ylbutanamide;hydrochloride
CID 119763294
N-[1-(2-methylpropanoyl)piperidin-4-yl]-3-piperidin-4-ylbutanamide
CID 119710904
N-[1-(3-methylbutanoyl)piperidin-4-yl]-3-piperidin-4-ylbutanamide
CID 119755741
3-piperidin-4-yl-N-(3-propan-2-ylcyclohexyl)butanamide;hydrochloride
CID 119775867
N-(4-methylcyclohexyl)-3-piperidin-3-ylbutanamide
CID 81044327
N-butan-2-yl-3-piperidin-4-ylbutanamide
CID 119669606
3-methyl-N-piperidin-4-ylpentanamide
CID 112703814
3-methyl-N-piperidin-4-ylhexanamide;hydrochloride
CID 119388134
N-[1-(4-tert-butylphenyl)piperidin-4-yl]-3-piperidin-4-ylbutanamide;dihydrochloride
CID 119862946
3-piperidin-4-yl-N-(2,2,2-trifluoroethyl)butanamide
CID 119726417
N-[1-(1-phenylethyl)piperidin-4-yl]-3-piperidin-4-ylbutanamide
CID 119879223

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-4-yl-N-(4-propylcyclohexyl)butanamide?
The IUPAC name of 3-piperidin-4-yl-N-(4-propylcyclohexyl)butanamide (CID 119750393) is 3-piperidin-4-yl-N-(4-propylcyclohexyl)butanamide.
What is the SMILES notation for 3-piperidin-4-yl-N-(4-propylcyclohexyl)butanamide?
The canonical SMILES for 3-piperidin-4-yl-N-(4-propylcyclohexyl)butanamide is CCCC1CCC(NC(=O)CC(C)C2CCNCC2)CC1.
What is the InChIKey of 3-piperidin-4-yl-N-(4-propylcyclohexyl)butanamide?
The InChIKey is XJMGKZKNHHOANQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O/c1-3-4-15-5-7-17(8-6-15)20-18(21)13-14(2)16-9-11-19-12-10-16/h14-17,19H,3-13H2,1-2H3,(H,20,21).
What are the key properties of 3-piperidin-4-yl-N-(4-propylcyclohexyl)butanamide?
3-piperidin-4-yl-N-(4-propylcyclohexyl)butanamide has a molecular weight of 294.48 g/mol, XLogP of 3.49, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-4-yl-N-(4-propylcyclohexyl)butanamide is sourced from PubChem (CID 119750393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).