1-N-cyclopropyl-4-N-[(3-methyl-4-phenylphenyl)methyl]piperidine-1,4-dicarboxamide

C24H29N3O2 — CID 166226120

IUPAC1-N-cyclopropyl-4-N-[(3-methyl-4-phenylphenyl)methyl]piperidine-1,4-dicarboxamide
SMILESCc1cc(CNC(=O)C2CCN(C(=O)NC3CC3)CC2)ccc1-c1ccccc1
InChIInChI=1S/C24H29N3O2/c1-17-15-18(7-10-22(17)19-5-3-2-4-6-19)16-25-23(28)20-11-13-27(14-12-20)24(29)26-21-8-9-21/h2-7,10,15,20-21H,8-9,11-14,16H2,1H3,(H,25,28)(H,26,29)
InChIKeyOOHTYDZKLZNREM-UHFFFAOYSA-N
MW391.52 g/mol
LogP3.86
Rot. Bonds5

About 1-N-cyclopropyl-4-N-[(3-methyl-4-phenylphenyl)methyl]piperidine-1,4-dicarboxamide

1-N-cyclopropyl-4-N-[(3-methyl-4-phenylphenyl)methyl]piperidine-1,4-dicarboxamide (PubChem CID 166226120) has the molecular formula C24H29N3O2 and a molecular weight of 391.52 g/mol. Its IUPAC name is 1-N-cyclopropyl-4-N-[(3-methyl-4-phenylphenyl)methyl]piperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N-cyclopropyl-4-N-[(3-methyl-4-phenylphenyl)methyl]piperidine-1,4-dicarboxamide
PubChem CID166226120
Molecular FormulaC24H29N3O2
Molecular Weight391.52 g/mol
Exact Mass391.23
IUPAC Name1-N-cyclopropyl-4-N-[(3-methyl-4-phenylphenyl)methyl]piperidine-1,4-dicarboxamide
SMILESCc1cc(CNC(=O)C2CCN(C(=O)NC3CC3)CC2)ccc1-c1ccccc1
InChIInChI=1S/C24H29N3O2/c1-17-15-18(7-10-22(17)19-5-3-2-4-6-19)16-25-23(28)20-11-13-27(14-12-20)24(29)26-21-8-9-21/h2-7,10,15,20-21H,8-9,11-14,16H2,1H3,(H,25,28)(H,26,29)
InChIKeyOOHTYDZKLZNREM-UHFFFAOYSA-N
XLogP3.86
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.52
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-N-cyclopropyl-4-N-[(3-methyl-4-phenylphenyl)methyl]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

Related Compounds

1-[(3-methyl-4-phenylphenyl)methylcarbamoyl]piperidine-4-carboxylic acid
CID 122010895
1-[(3-methyl-4-phenylphenyl)methylcarbamoyl]piperidine-3-carboxylic acid
CID 122010900
1-N-cyclohexyl-4-N-[(4-methylphenyl)methyl]piperidine-1,4-dicarboxamide
CID 1083731
4-N-benzyl-1-N-(1-cyclopropylpiperidin-4-yl)piperidine-1,4-dicarboxamide
CID 87003142
N-[(4-fluoro-3-methylphenyl)methyl]-1-(2-phenoxyacetyl)piperidine-4-carboxamide
CID 86931753
N-benzyl-4-(cyclobutanecarbonylamino)piperidine-1-carboxamide
CID 110821711
N-benzyl-1-[2-(2,6-dimethylphenoxy)acetyl]piperidine-4-carboxamide
CID 26456516
4-N-[(3-chlorophenyl)methyl]-1-N-phenylpiperidine-1,4-dicarboxamide
CID 7478442
N-[(3-fluoro-4-methylphenyl)methyl]-1-(5-phenyl-1H-pyrazole-4-carbonyl)piperidine-4-carboxamide
CID 55724707
1-N-cyclopropyl-4-N-[2-(2-fluorophenyl)ethyl]piperidine-1,4-dicarboxamide
CID 113004650
1-N-cyclohexyl-4-N-(pyridin-2-ylmethyl)piperidine-1,4-dicarboxamide
CID 113004461
1-(3-amino-3-phenylpropanoyl)-N-[(3-fluoro-4-methylphenyl)methyl]piperidine-4-carboxamide
CID 119949794

Frequently Asked Questions

What is the IUPAC name of 1-N-cyclopropyl-4-N-[(3-methyl-4-phenylphenyl)methyl]piperidine-1,4-dicarboxamide?
The IUPAC name of 1-N-cyclopropyl-4-N-[(3-methyl-4-phenylphenyl)methyl]piperidine-1,4-dicarboxamide (CID 166226120) is 1-N-cyclopropyl-4-N-[(3-methyl-4-phenylphenyl)methyl]piperidine-1,4-dicarboxamide.
What is the SMILES notation for 1-N-cyclopropyl-4-N-[(3-methyl-4-phenylphenyl)methyl]piperidine-1,4-dicarboxamide?
The canonical SMILES for 1-N-cyclopropyl-4-N-[(3-methyl-4-phenylphenyl)methyl]piperidine-1,4-dicarboxamide is Cc1cc(CNC(=O)C2CCN(C(=O)NC3CC3)CC2)ccc1-c1ccccc1.
What is the InChIKey of 1-N-cyclopropyl-4-N-[(3-methyl-4-phenylphenyl)methyl]piperidine-1,4-dicarboxamide?
The InChIKey is OOHTYDZKLZNREM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N3O2/c1-17-15-18(7-10-22(17)19-5-3-2-4-6-19)16-25-23(28)20-11-13-27(14-12-20)24(29)26-21-8-9-21/h2-7,10,15,20-21H,8-9,11-14,16H2,1H3,(H,25,28)(H,26,29).
What are the key properties of 1-N-cyclopropyl-4-N-[(3-methyl-4-phenylphenyl)methyl]piperidine-1,4-dicarboxamide?
1-N-cyclopropyl-4-N-[(3-methyl-4-phenylphenyl)methyl]piperidine-1,4-dicarboxamide has a molecular weight of 391.52 g/mol, XLogP of 3.86, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-cyclopropyl-4-N-[(3-methyl-4-phenylphenyl)methyl]piperidine-1,4-dicarboxamide is sourced from PubChem (CID 166226120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).