5-(4-benzylpiperazin-1-yl)-N-cyclopentylpyridine-2-carboxamide

C22H28N4O — CID 109182201

IUPAC5-(4-benzylpiperazin-1-yl)-N-cyclopentylpyridine-2-carboxamide
SMILESO=C(NC1CCCC1)c1ccc(N2CCN(Cc3ccccc3)CC2)cn1
InChIInChI=1S/C22H28N4O/c27-22(24-19-8-4-5-9-19)21-11-10-20(16-23-21)26-14-12-25(13-15-26)17-18-6-2-1-3-7-18/h1-3,6-7,10-11,16,19H,4-5,8-9,12-15,17H2,(H,24,27)
InChIKeyRLEXKQHCSUAALV-UHFFFAOYSA-N
MW364.49 g/mol
LogP3.08
Rot. Bonds5

About 5-(4-benzylpiperazin-1-yl)-N-cyclopentylpyridine-2-carboxamide

5-(4-benzylpiperazin-1-yl)-N-cyclopentylpyridine-2-carboxamide (PubChem CID 109182201) has the molecular formula C22H28N4O and a molecular weight of 364.49 g/mol. Its IUPAC name is 5-(4-benzylpiperazin-1-yl)-N-cyclopentylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-(4-benzylpiperazin-1-yl)-N-cyclopentylpyridine-2-carboxamide
PubChem CID109182201
Molecular FormulaC22H28N4O
Molecular Weight364.49 g/mol
Exact Mass364.23
IUPAC Name5-(4-benzylpiperazin-1-yl)-N-cyclopentylpyridine-2-carboxamide
SMILESO=C(NC1CCCC1)c1ccc(N2CCN(Cc3ccccc3)CC2)cn1
InChIInChI=1S/C22H28N4O/c27-22(24-19-8-4-5-9-19)21-11-10-20(16-23-21)26-14-12-25(13-15-26)17-18-6-2-1-3-7-18/h1-3,6-7,10-11,16,19H,4-5,8-9,12-15,17H2,(H,24,27)
InChIKeyRLEXKQHCSUAALV-UHFFFAOYSA-N
XLogP3.08
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.49
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(4-benzylpiperazin-1-yl)-N-cyclopentylpyridine-2-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

5-(4-benzylpiperazin-1-yl)-N-[1-[(4-cyanophenyl)methyl]piperidin-4-yl]pyridine-2-carboxamide
CID 66710221
5-(azepan-1-yl)-N-cyclohexylpyridine-2-carboxamide
CID 109182978
5-(4-benzylpiperazin-1-yl)-N-tert-butylpyridine-2-carboxamide
CID 109193366
N-cyclohexyl-5-(4-pyrimidin-2-ylpiperazin-1-yl)pyridine-2-carboxamide
CID 109182962
N-cyclopentyl-5-[4-(4-fluorophenyl)piperazin-1-yl]pyridine-2-carboxamide
CID 109182203
5-(4-benzylpiperazine-1-carbonyl)-N-(1-benzylpiperidin-4-yl)pyridine-2-carboxamide
CID 56650667
2-(4-benzylpiperazin-1-yl)-N-cyclopentyl-6-methylpyrimidine-4-carboxamide
CID 109322138
N-cyclopropyl-5-[4-[(7-cyclopropyl-6-oxo-5H-1,5-naphthyridin-3-yl)methyl]piperazin-1-yl]pyridine-2-carboxamide
CID 166021917
N-cyclopropyl-5-morpholin-4-ylpyridine-2-carboxamide
CID 109179845
N-cyclohexyl-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide
CID 109182975
2-(4-benzylpiperazin-1-yl)-N-cyclopropyl-6-methylpyrimidine-4-carboxamide
CID 109319885
N-(1-benzylpiperidin-4-yl)-6-methylpyridine-2-carboxamide
CID 31926879

Frequently Asked Questions

What is the IUPAC name of 5-(4-benzylpiperazin-1-yl)-N-cyclopentylpyridine-2-carboxamide?
The IUPAC name of 5-(4-benzylpiperazin-1-yl)-N-cyclopentylpyridine-2-carboxamide (CID 109182201) is 5-(4-benzylpiperazin-1-yl)-N-cyclopentylpyridine-2-carboxamide.
What is the SMILES notation for 5-(4-benzylpiperazin-1-yl)-N-cyclopentylpyridine-2-carboxamide?
The canonical SMILES for 5-(4-benzylpiperazin-1-yl)-N-cyclopentylpyridine-2-carboxamide is O=C(NC1CCCC1)c1ccc(N2CCN(Cc3ccccc3)CC2)cn1.
What is the InChIKey of 5-(4-benzylpiperazin-1-yl)-N-cyclopentylpyridine-2-carboxamide?
The InChIKey is RLEXKQHCSUAALV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N4O/c27-22(24-19-8-4-5-9-19)21-11-10-20(16-23-21)26-14-12-25(13-15-26)17-18-6-2-1-3-7-18/h1-3,6-7,10-11,16,19H,4-5,8-9,12-15,17H2,(H,24,27).
What are the key properties of 5-(4-benzylpiperazin-1-yl)-N-cyclopentylpyridine-2-carboxamide?
5-(4-benzylpiperazin-1-yl)-N-cyclopentylpyridine-2-carboxamide has a molecular weight of 364.49 g/mol, XLogP of 3.08, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-benzylpiperazin-1-yl)-N-cyclopentylpyridine-2-carboxamide is sourced from PubChem (CID 109182201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).