1-N-cyclohexyl-4-N-(2-methylphenyl)piperidine-1,4-dicarboxamide

C20H29N3O2 — CID 24792693

IUPAC1-N-cyclohexyl-4-N-(2-methylphenyl)piperidine-1,4-dicarboxamide
SMILESCc1ccccc1NC(=O)C1CCN(C(=O)NC2CCCCC2)CC1
InChIInChI=1S/C20H29N3O2/c1-15-7-5-6-10-18(15)22-19(24)16-11-13-23(14-12-16)20(25)21-17-8-3-2-4-9-17/h5-7,10,16-17H,2-4,8-9,11-14H2,1H3,(H,21,25)(H,22,24)
InChIKeyVGTMFYOMTCOTIX-UHFFFAOYSA-N
MW343.47 g/mol
LogP3.69
Rot. Bonds3

About 1-N-cyclohexyl-4-N-(2-methylphenyl)piperidine-1,4-dicarboxamide

1-N-cyclohexyl-4-N-(2-methylphenyl)piperidine-1,4-dicarboxamide (PubChem CID 24792693) has the molecular formula C20H29N3O2 and a molecular weight of 343.47 g/mol. Its IUPAC name is 1-N-cyclohexyl-4-N-(2-methylphenyl)piperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N-cyclohexyl-4-N-(2-methylphenyl)piperidine-1,4-dicarboxamide
PubChem CID24792693
Molecular FormulaC20H29N3O2
Molecular Weight343.47 g/mol
Exact Mass343.23
IUPAC Name1-N-cyclohexyl-4-N-(2-methylphenyl)piperidine-1,4-dicarboxamide
SMILESCc1ccccc1NC(=O)C1CCN(C(=O)NC2CCCCC2)CC1
InChIInChI=1S/C20H29N3O2/c1-15-7-5-6-10-18(15)22-19(24)16-11-13-23(14-12-16)20(25)21-17-8-3-2-4-9-17/h5-7,10,16-17H,2-4,8-9,11-14H2,1H3,(H,21,25)(H,22,24)
InChIKeyVGTMFYOMTCOTIX-UHFFFAOYSA-N
XLogP3.69
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.47
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-N-cyclohexyl-4-N-(2-methylphenyl)piperidine-1,4-dicarboxamide 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 1-N-cyclohexyl-4-N-(2-methylphenyl)piperidine-1,4-dicarboxamide?
The IUPAC name of 1-N-cyclohexyl-4-N-(2-methylphenyl)piperidine-1,4-dicarboxamide (CID 24792693) is 1-N-cyclohexyl-4-N-(2-methylphenyl)piperidine-1,4-dicarboxamide.
What is the SMILES notation for 1-N-cyclohexyl-4-N-(2-methylphenyl)piperidine-1,4-dicarboxamide?
The canonical SMILES for 1-N-cyclohexyl-4-N-(2-methylphenyl)piperidine-1,4-dicarboxamide is Cc1ccccc1NC(=O)C1CCN(C(=O)NC2CCCCC2)CC1.
What is the InChIKey of 1-N-cyclohexyl-4-N-(2-methylphenyl)piperidine-1,4-dicarboxamide?
The InChIKey is VGTMFYOMTCOTIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O2/c1-15-7-5-6-10-18(15)22-19(24)16-11-13-23(14-12-16)20(25)21-17-8-3-2-4-9-17/h5-7,10,16-17H,2-4,8-9,11-14H2,1H3,(H,21,25)(H,22,24).
What are the key properties of 1-N-cyclohexyl-4-N-(2-methylphenyl)piperidine-1,4-dicarboxamide?
1-N-cyclohexyl-4-N-(2-methylphenyl)piperidine-1,4-dicarboxamide has a molecular weight of 343.47 g/mol, XLogP of 3.69, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-cyclohexyl-4-N-(2-methylphenyl)piperidine-1,4-dicarboxamide is sourced from PubChem (CID 24792693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).