N-(5-hydroxy-2-adamantyl)-6-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide

C26H32N4O2 — CID 67466819

IUPACN-(5-hydroxy-2-adamantyl)-6-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide
SMILESO=C(NC1C2CC3CC1CC(O)(C3)C2)c1cccc(N2CCN(c3ccccc3)CC2)n1
InChIInChI=1S/C26H32N4O2/c31-25(28-24-19-13-18-14-20(24)17-26(32,15-18)16-19)22-7-4-8-23(27-22)30-11-9-29(10-12-30)21-5-2-1-3-6-21/h1-8,18-20,24,32H,9-17H2,(H,28,31)
InChIKeyMDXZTCQQFFSNJD-UHFFFAOYSA-N
MW432.57 g/mol
LogP3.08
Rot. Bonds4

About N-(5-hydroxy-2-adamantyl)-6-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide

N-(5-hydroxy-2-adamantyl)-6-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide (PubChem CID 67466819) has the molecular formula C26H32N4O2 and a molecular weight of 432.57 g/mol. Its IUPAC name is N-(5-hydroxy-2-adamantyl)-6-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(5-hydroxy-2-adamantyl)-6-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide
PubChem CID67466819
Molecular FormulaC26H32N4O2
Molecular Weight432.57 g/mol
Exact Mass432.25
IUPAC NameN-(5-hydroxy-2-adamantyl)-6-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide
SMILESO=C(NC1C2CC3CC1CC(O)(C3)C2)c1cccc(N2CCN(c3ccccc3)CC2)n1
InChIInChI=1S/C26H32N4O2/c31-25(28-24-19-13-18-14-20(24)17-26(32,15-18)16-19)22-7-4-8-23(27-22)30-11-9-29(10-12-30)21-5-2-1-3-6-21/h1-8,18-20,24,32H,9-17H2,(H,28,31)
InChIKeyMDXZTCQQFFSNJD-UHFFFAOYSA-N
XLogP3.08
TPSA68.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.57
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(5-hydroxy-2-adamantyl)-6-(4-phenylpiperazin-1-yl)pyridine-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

6-[4-(4-carbamoyl-3-fluorophenyl)piperazin-1-yl]-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide
CID 54590965
N-(5-hydroxy-2-adamantyl)-6-(4-pyridin-2-ylpiperidin-1-yl)pyridine-2-carboxamide
CID 54591981
N-(5-hydroxy-2-adamantyl)-6-[4-(4-methoxyphenyl)piperidin-1-yl]pyridine-2-carboxamide
CID 54591134
6-[4-(4-carbamoylphenyl)piperidin-1-yl]-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide
CID 67468209
N-(5-hydroxy-2-adamantyl)-6-[(2R)-4-[4-(1-hydroxycyclopropyl)phenyl]-2-methylpiperazin-1-yl]pyridine-2-carboxamide
CID 67463119
N-(5-hydroxy-2-adamantyl)-6-[(2R)-2-methyl-4-[4-(methylcarbamoyl)phenyl]piperazin-1-yl]pyridine-2-carboxamide
CID 54591293
6-[(2R)-4-[4-(dimethylamino)phenyl]-2-methylpiperazin-1-yl]-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide
CID 67468551
6-[(2R)-4-[4-(2-aminopropan-2-yl)phenyl]-2-methylpiperazin-1-yl]-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide
CID 67468039
6-[(3R)-4-[6-[(5-hydroxy-2-adamantyl)carbamoyl]-2-pyridinyl]-3-methylpiperazin-1-yl]pyridine-3-carboxylic acid
CID 67468478
N-(5-hydroxy-2-adamantyl)-6-[4-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-2-methylpiperazin-1-yl]pyridine-2-carboxamide
CID 67468869
6-[4-(5-carbamoyl-2-pyridinyl)-2-methylpiperazin-1-yl]-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide
CID 67464213
N-(5-hydroxy-2-adamantyl)-6-[(2R)-2-methyl-4-(oxan-4-yl)piperazin-1-yl]pyridine-2-carboxamide
CID 67468040

Frequently Asked Questions

What is the IUPAC name of N-(5-hydroxy-2-adamantyl)-6-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide?
The IUPAC name of N-(5-hydroxy-2-adamantyl)-6-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide (CID 67466819) is N-(5-hydroxy-2-adamantyl)-6-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-(5-hydroxy-2-adamantyl)-6-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide?
The canonical SMILES for N-(5-hydroxy-2-adamantyl)-6-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide is O=C(NC1C2CC3CC1CC(O)(C3)C2)c1cccc(N2CCN(c3ccccc3)CC2)n1.
What is the InChIKey of N-(5-hydroxy-2-adamantyl)-6-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide?
The InChIKey is MDXZTCQQFFSNJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H32N4O2/c31-25(28-24-19-13-18-14-20(24)17-26(32,15-18)16-19)22-7-4-8-23(27-22)30-11-9-29(10-12-30)21-5-2-1-3-6-21/h1-8,18-20,24,32H,9-17H2,(H,28,31).
What are the key properties of N-(5-hydroxy-2-adamantyl)-6-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide?
N-(5-hydroxy-2-adamantyl)-6-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide has a molecular weight of 432.57 g/mol, XLogP of 3.08, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-hydroxy-2-adamantyl)-6-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide is sourced from PubChem (CID 67466819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).