N-(4-methylcyclohexyl)-3-piperidin-3-ylbutanamide

C16H30N2O — CID 81044327

IUPACN-(4-methylcyclohexyl)-3-piperidin-3-ylbutanamide
SMILESCC1CCC(NC(=O)CC(C)C2CCCNC2)CC1
InChIInChI=1S/C16H30N2O/c1-12-5-7-15(8-6-12)18-16(19)10-13(2)14-4-3-9-17-11-14/h12-15,17H,3-11H2,1-2H3,(H,18,19)
InChIKeyJHJKGGYREMSWMW-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.71
Rot. Bonds4

About N-(4-methylcyclohexyl)-3-piperidin-3-ylbutanamide

N-(4-methylcyclohexyl)-3-piperidin-3-ylbutanamide (PubChem CID 81044327) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is N-(4-methylcyclohexyl)-3-piperidin-3-ylbutanamide.

Molecular Properties

Compound NameN-(4-methylcyclohexyl)-3-piperidin-3-ylbutanamide
PubChem CID81044327
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC NameN-(4-methylcyclohexyl)-3-piperidin-3-ylbutanamide
SMILESCC1CCC(NC(=O)CC(C)C2CCCNC2)CC1
InChIInChI=1S/C16H30N2O/c1-12-5-7-15(8-6-12)18-16(19)10-13(2)14-4-3-9-17-11-14/h12-15,17H,3-11H2,1-2H3,(H,18,19)
InChIKeyJHJKGGYREMSWMW-UHFFFAOYSA-N
XLogP2.71
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-hydroxycyclohexyl)-3-piperidin-3-ylbutanamide
CID 81043560
N-(1,1-dioxothian-4-yl)-3-piperidin-3-ylbutanamide
CID 81044428
3-piperidin-3-yl-N-[4-(trifluoromethyl)cyclohexyl]butanamide;hydrochloride
CID 119701805
N-[3-(cyclopropylamino)-3-oxopropyl]-3-piperidin-3-ylbutanamide
CID 81044384
N-(2,4-dimethylcyclohexyl)-3-piperidin-3-ylbutanamide;hydrochloride
CID 119784945
3-piperidin-3-yl-N-(1-propylpiperidin-4-yl)butanamide
CID 81048676
N-(1-cyclopropylpiperidin-4-yl)-3-piperidin-3-ylbutanamide;dihydrochloride
CID 119840395
N-[4-(cyclopropylamino)-4-oxobutyl]-3-piperidin-3-ylbutanamide;hydrochloride
CID 119728333
N-(oxan-3-yl)-3-piperidin-3-ylbutanamide
CID 81043949
N-(1-methylpiperidin-3-yl)-3-piperidin-3-ylbutanamide
CID 81043754
N-(1,2-dimethylpiperidin-4-yl)-3-piperidin-3-ylbutanamide;dihydrochloride
CID 119886287
N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-3-piperidin-3-ylbutanamide
CID 119900324

Frequently Asked Questions

What is the IUPAC name of N-(4-methylcyclohexyl)-3-piperidin-3-ylbutanamide?
The IUPAC name of N-(4-methylcyclohexyl)-3-piperidin-3-ylbutanamide (CID 81044327) is N-(4-methylcyclohexyl)-3-piperidin-3-ylbutanamide.
What is the SMILES notation for N-(4-methylcyclohexyl)-3-piperidin-3-ylbutanamide?
The canonical SMILES for N-(4-methylcyclohexyl)-3-piperidin-3-ylbutanamide is CC1CCC(NC(=O)CC(C)C2CCCNC2)CC1.
What is the InChIKey of N-(4-methylcyclohexyl)-3-piperidin-3-ylbutanamide?
The InChIKey is JHJKGGYREMSWMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-12-5-7-15(8-6-12)18-16(19)10-13(2)14-4-3-9-17-11-14/h12-15,17H,3-11H2,1-2H3,(H,18,19).
What are the key properties of N-(4-methylcyclohexyl)-3-piperidin-3-ylbutanamide?
N-(4-methylcyclohexyl)-3-piperidin-3-ylbutanamide has a molecular weight of 266.43 g/mol, XLogP of 2.71, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylcyclohexyl)-3-piperidin-3-ylbutanamide is sourced from PubChem (CID 81044327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).