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

C17H32N2O — CID 119717321

IUPACN-methyl-N-(3-methylcyclohexyl)-3-piperidin-4-ylbutanamide
SMILESCC1CCCC(N(C)C(=O)CC(C)C2CCNCC2)C1
InChIInChI=1S/C17H32N2O/c1-13-5-4-6-16(11-13)19(3)17(20)12-14(2)15-7-9-18-10-8-15/h13-16,18H,4-12H2,1-3H3
InChIKeyHRQUYCMTKDCUNR-UHFFFAOYSA-N
MW280.46 g/mol
LogP3.05
Rot. Bonds4

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

N-methyl-N-(3-methylcyclohexyl)-3-piperidin-4-ylbutanamide (PubChem CID 119717321) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is N-methyl-N-(3-methylcyclohexyl)-3-piperidin-4-ylbutanamide.

Molecular Properties

Compound NameN-methyl-N-(3-methylcyclohexyl)-3-piperidin-4-ylbutanamide
PubChem CID119717321
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC NameN-methyl-N-(3-methylcyclohexyl)-3-piperidin-4-ylbutanamide
SMILESCC1CCCC(N(C)C(=O)CC(C)C2CCNCC2)C1
InChIInChI=1S/C17H32N2O/c1-13-5-4-6-16(11-13)19(3)17(20)12-14(2)15-7-9-18-10-8-15/h13-16,18H,4-12H2,1-3H3
InChIKeyHRQUYCMTKDCUNR-UHFFFAOYSA-N
XLogP3.05
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-methyl-N-(3-methylcyclohexyl)-3-piperidin-4-ylbutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4,4-dimethylcyclohexyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride
CID 119791939
3-amino-N-methyl-N-(3-methylcyclohexyl)butanamide
CID 61447077
N-(1-ethylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide
CID 119841958
N-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-piperidin-4-ylbutanamide
CID 119746206
N-cyclopropyl-N-ethyl-3-piperidin-4-ylbutanamide
CID 119718930
N-methyl-N-(3-methylcyclohexyl)piperidine-4-carboxamide;hydrochloride
CID 119285985
N-(dicyclopropylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride
CID 119760613
4-hydroxy-N-methyl-N-(3-methylcyclohexyl)pentanamide
CID 79192365
N-(1-benzylpiperidin-3-yl)-N-methyl-3-piperidin-4-ylbutanamide;dihydrochloride
CID 119857579
N-(1-ethyl-3-methylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide
CID 119893449
N-(3-methoxy-2,2,3-trimethylcyclobutyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride
CID 119817568
1-(2,6-dimethylpiperidin-1-yl)-3-piperidin-4-ylbutan-1-one
CID 119671942

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(3-methylcyclohexyl)-3-piperidin-4-ylbutanamide?
The IUPAC name of N-methyl-N-(3-methylcyclohexyl)-3-piperidin-4-ylbutanamide (CID 119717321) is N-methyl-N-(3-methylcyclohexyl)-3-piperidin-4-ylbutanamide.
What is the SMILES notation for N-methyl-N-(3-methylcyclohexyl)-3-piperidin-4-ylbutanamide?
The canonical SMILES for N-methyl-N-(3-methylcyclohexyl)-3-piperidin-4-ylbutanamide is CC1CCCC(N(C)C(=O)CC(C)C2CCNCC2)C1.
What is the InChIKey of N-methyl-N-(3-methylcyclohexyl)-3-piperidin-4-ylbutanamide?
The InChIKey is HRQUYCMTKDCUNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-13-5-4-6-16(11-13)19(3)17(20)12-14(2)15-7-9-18-10-8-15/h13-16,18H,4-12H2,1-3H3.
What are the key properties of N-methyl-N-(3-methylcyclohexyl)-3-piperidin-4-ylbutanamide?
N-methyl-N-(3-methylcyclohexyl)-3-piperidin-4-ylbutanamide has a molecular weight of 280.46 g/mol, XLogP of 3.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(3-methylcyclohexyl)-3-piperidin-4-ylbutanamide is sourced from PubChem (CID 119717321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).