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

C24H33N3O3 — CID 54591822

IUPAC6-(4-cyclopropyl-4-hydroxypiperidin-1-yl)-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide
SMILESO=C(NC1C2CC3CC1CC(O)(C3)C2)c1cccc(N2CCC(O)(C3CC3)CC2)n1
InChIInChI=1S/C24H33N3O3/c28-22(26-21-16-10-15-11-17(21)14-23(29,12-15)13-16)19-2-1-3-20(25-19)27-8-6-24(30,7-9-27)18-4-5-18/h1-3,15-18,21,29-30H,4-14H2,(H,26,28)
InChIKeyCVLDWMLKVFHERL-UHFFFAOYSA-N
MW411.55 g/mol
LogP2.49
Rot. Bonds4

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

6-(4-cyclopropyl-4-hydroxypiperidin-1-yl)-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide (PubChem CID 54591822) has the molecular formula C24H33N3O3 and a molecular weight of 411.55 g/mol. Its IUPAC name is 6-(4-cyclopropyl-4-hydroxypiperidin-1-yl)-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(4-cyclopropyl-4-hydroxypiperidin-1-yl)-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide
PubChem CID54591822
Molecular FormulaC24H33N3O3
Molecular Weight411.55 g/mol
Exact Mass411.25
IUPAC Name6-(4-cyclopropyl-4-hydroxypiperidin-1-yl)-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide
SMILESO=C(NC1C2CC3CC1CC(O)(C3)C2)c1cccc(N2CCC(O)(C3CC3)CC2)n1
InChIInChI=1S/C24H33N3O3/c28-22(26-21-16-10-15-11-17(21)14-23(29,12-15)13-16)19-2-1-3-20(25-19)27-8-6-24(30,7-9-27)18-4-5-18/h1-3,15-18,21,29-30H,4-14H2,(H,26,28)
InChIKeyCVLDWMLKVFHERL-UHFFFAOYSA-N
XLogP2.49
TPSA85.69 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.55
LogP ≤ 52.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 6-(4-cyclopropyl-4-hydroxypiperidin-1-yl)-N-(5-hydroxy-2-adamantyl)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-carbamoylphenyl)piperazin-1-yl]-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide
CID 67465189
6-[4-(4-aminophenyl)piperazin-1-yl]-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide
CID 54590875
N-(5-hydroxy-2-adamantyl)-6-[4-(4-methylsulfonylphenyl)piperazin-1-yl]pyridine-2-carboxamide
CID 54590876
6-[4-(4-cyano-3-fluorophenyl)piperazin-1-yl]-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide
CID 54590877
6-[4-(2-chloro-4-cyanophenyl)piperazin-1-yl]-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide
CID 54590878
6-[4-(4-carbamoyl-3-fluorophenyl)piperazin-1-yl]-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide
CID 54590965
6-[4-(4-carbamoyl-2-chlorophenyl)piperazin-1-yl]-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide
CID 54590966
6-[4-(5-cyano-2-pyridinyl)piperazin-1-yl]-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide
CID 54591053
N-(5-hydroxy-2-adamantyl)-6-[(2R)-2-methyl-4-[4-(methylcarbamoyl)phenyl]piperazin-1-yl]pyridine-2-carboxamide
CID 54591293
N-(5-hydroxy-2-adamantyl)-6-[4-hydroxy-4-(trifluoromethyl)piperidin-1-yl]pyridine-2-carboxamide
CID 54591749
N-(5-hydroxy-2-adamantyl)-6-piperidin-1-ylpyridine-2-carboxamide
CID 54591819
N-(5-hydroxy-2-adamantyl)-6-(4-hydroxy-4-methylpiperidin-1-yl)pyridine-2-carboxamide
CID 54591821

Frequently Asked Questions

What is the IUPAC name of 6-(4-cyclopropyl-4-hydroxypiperidin-1-yl)-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide?
The IUPAC name of 6-(4-cyclopropyl-4-hydroxypiperidin-1-yl)-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide (CID 54591822) is 6-(4-cyclopropyl-4-hydroxypiperidin-1-yl)-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-(4-cyclopropyl-4-hydroxypiperidin-1-yl)-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide?
The canonical SMILES for 6-(4-cyclopropyl-4-hydroxypiperidin-1-yl)-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide is O=C(NC1C2CC3CC1CC(O)(C3)C2)c1cccc(N2CCC(O)(C3CC3)CC2)n1.
What is the InChIKey of 6-(4-cyclopropyl-4-hydroxypiperidin-1-yl)-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide?
The InChIKey is CVLDWMLKVFHERL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N3O3/c28-22(26-21-16-10-15-11-17(21)14-23(29,12-15)13-16)19-2-1-3-20(25-19)27-8-6-24(30,7-9-27)18-4-5-18/h1-3,15-18,21,29-30H,4-14H2,(H,26,28).
What are the key properties of 6-(4-cyclopropyl-4-hydroxypiperidin-1-yl)-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide?
6-(4-cyclopropyl-4-hydroxypiperidin-1-yl)-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide has a molecular weight of 411.55 g/mol, XLogP of 2.49, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-cyclopropyl-4-hydroxypiperidin-1-yl)-N-(5-hydroxy-2-adamantyl)pyridine-2-carboxamide is sourced from PubChem (CID 54591822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).