N-(4-methyl-2-pyridinyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide

C21H25N3O2 — CID 46411285

IUPACN-(4-methyl-2-pyridinyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide
SMILESCc1ccnc(NC(=O)C2CCN(C(=O)CCc3ccccc3)CC2)c1
InChIInChI=1S/C21H25N3O2/c1-16-9-12-22-19(15-16)23-21(26)18-10-13-24(14-11-18)20(25)8-7-17-5-3-2-4-6-17/h2-6,9,12,15,18H,7-8,10-11,13-14H2,1H3,(H,22,23,26)
InChIKeyXFGNZBQLVNPIAM-UHFFFAOYSA-N
MW351.45 g/mol
LogP3.20
Rot. Bonds5

About N-(4-methyl-2-pyridinyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide

N-(4-methyl-2-pyridinyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide (PubChem CID 46411285) has the molecular formula C21H25N3O2 and a molecular weight of 351.45 g/mol. Its IUPAC name is N-(4-methyl-2-pyridinyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(4-methyl-2-pyridinyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide
PubChem CID46411285
Molecular FormulaC21H25N3O2
Molecular Weight351.45 g/mol
Exact Mass351.19
IUPAC NameN-(4-methyl-2-pyridinyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide
SMILESCc1ccnc(NC(=O)C2CCN(C(=O)CCc3ccccc3)CC2)c1
InChIInChI=1S/C21H25N3O2/c1-16-9-12-22-19(15-16)23-21(26)18-10-13-24(14-11-18)20(25)8-7-17-5-3-2-4-6-17/h2-6,9,12,15,18H,7-8,10-11,13-14H2,1H3,(H,22,23,26)
InChIKeyXFGNZBQLVNPIAM-UHFFFAOYSA-N
XLogP3.20
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.45
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(4-methyl-2-pyridinyl)-1-(3-phenylpropanoyl)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

Related Compounds

1-[4-(4-chlorophenyl)butanoyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 55930872
N-(3-methylphenyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide
CID 113006134
N-(4-methyl-2-pyridinyl)-1-[2-oxo-2-[4-(phenylcarbamoyl)piperidin-1-yl]ethyl]piperidine-4-carboxamide
CID 55922165
1-[2-(2-methylindol-1-yl)acetyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 55815306
N-(2-benzylpyrazol-3-yl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide
CID 55631067
1-(3-phenylpropanoyl)piperidine-4-carbohydrazide
CID 54794050
1-[2-(benzylcarbamoylamino)-3-methylbutanoyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 55992027
1-(2-fluorobenzoyl)-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 17019017
N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1-(3-phenylpropanoyl)piperidine-4-carboxamide
CID 46409351
N-(6-amino-3-pyridinyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide
CID 119514987
1-[2-[4-(difluoromethoxy)phenyl]acetyl]-N-(4-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 55931889
1-(3-phenylpropanoyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 46411181

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2-pyridinyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide?
The IUPAC name of N-(4-methyl-2-pyridinyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide (CID 46411285) is N-(4-methyl-2-pyridinyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(4-methyl-2-pyridinyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide?
The canonical SMILES for N-(4-methyl-2-pyridinyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide is Cc1ccnc(NC(=O)C2CCN(C(=O)CCc3ccccc3)CC2)c1.
What is the InChIKey of N-(4-methyl-2-pyridinyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide?
The InChIKey is XFGNZBQLVNPIAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O2/c1-16-9-12-22-19(15-16)23-21(26)18-10-13-24(14-11-18)20(25)8-7-17-5-3-2-4-6-17/h2-6,9,12,15,18H,7-8,10-11,13-14H2,1H3,(H,22,23,26).
What are the key properties of N-(4-methyl-2-pyridinyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide?
N-(4-methyl-2-pyridinyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide has a molecular weight of 351.45 g/mol, XLogP of 3.20, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2-pyridinyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide is sourced from PubChem (CID 46411285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).