N-(2,3-dimethylcyclohexyl)-1-(furan-3-carbonyl)piperidine-4-carboxamide

C19H28N2O3 — CID 134060586

IUPACN-(2,3-dimethylcyclohexyl)-1-(furan-3-carbonyl)piperidine-4-carboxamide
SMILESCC1CCCC(NC(=O)C2CCN(C(=O)c3ccoc3)CC2)C1C
InChIInChI=1S/C19H28N2O3/c1-13-4-3-5-17(14(13)2)20-18(22)15-6-9-21(10-7-15)19(23)16-8-11-24-12-16/h8,11-15,17H,3-7,9-10H2,1-2H3,(H,20,22)
InChIKeyCRPZAAFXFAYMDN-UHFFFAOYSA-N
MW332.44 g/mol
LogP3.07
Rot. Bonds3

About N-(2,3-dimethylcyclohexyl)-1-(furan-3-carbonyl)piperidine-4-carboxamide

N-(2,3-dimethylcyclohexyl)-1-(furan-3-carbonyl)piperidine-4-carboxamide (PubChem CID 134060586) has the molecular formula C19H28N2O3 and a molecular weight of 332.44 g/mol. Its IUPAC name is N-(2,3-dimethylcyclohexyl)-1-(furan-3-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2,3-dimethylcyclohexyl)-1-(furan-3-carbonyl)piperidine-4-carboxamide
PubChem CID134060586
Molecular FormulaC19H28N2O3
Molecular Weight332.44 g/mol
Exact Mass332.21
IUPAC NameN-(2,3-dimethylcyclohexyl)-1-(furan-3-carbonyl)piperidine-4-carboxamide
SMILESCC1CCCC(NC(=O)C2CCN(C(=O)c3ccoc3)CC2)C1C
InChIInChI=1S/C19H28N2O3/c1-13-4-3-5-17(14(13)2)20-18(22)15-6-9-21(10-7-15)19(23)16-8-11-24-12-16/h8,11-15,17H,3-7,9-10H2,1-2H3,(H,20,22)
InChIKeyCRPZAAFXFAYMDN-UHFFFAOYSA-N
XLogP3.07
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.44
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2,3-dimethylcyclohexyl)-1-(furan-3-carbonyl)piperidine-4-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylcyclohexyl)-1-(furan-3-carbonyl)piperidine-4-carboxamide?
The IUPAC name of N-(2,3-dimethylcyclohexyl)-1-(furan-3-carbonyl)piperidine-4-carboxamide (CID 134060586) is N-(2,3-dimethylcyclohexyl)-1-(furan-3-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(2,3-dimethylcyclohexyl)-1-(furan-3-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for N-(2,3-dimethylcyclohexyl)-1-(furan-3-carbonyl)piperidine-4-carboxamide is CC1CCCC(NC(=O)C2CCN(C(=O)c3ccoc3)CC2)C1C.
What is the InChIKey of N-(2,3-dimethylcyclohexyl)-1-(furan-3-carbonyl)piperidine-4-carboxamide?
The InChIKey is CRPZAAFXFAYMDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O3/c1-13-4-3-5-17(14(13)2)20-18(22)15-6-9-21(10-7-15)19(23)16-8-11-24-12-16/h8,11-15,17H,3-7,9-10H2,1-2H3,(H,20,22).
What are the key properties of N-(2,3-dimethylcyclohexyl)-1-(furan-3-carbonyl)piperidine-4-carboxamide?
N-(2,3-dimethylcyclohexyl)-1-(furan-3-carbonyl)piperidine-4-carboxamide has a molecular weight of 332.44 g/mol, XLogP of 3.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylcyclohexyl)-1-(furan-3-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 134060586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).