6-(4-hydroxypiperidin-1-yl)-N-[3-(pyridine-2-carbonylamino)-1-adamantyl]pyridine-2-carboxamide

C27H33N5O3 — CID 58358655

IUPAC6-(4-hydroxypiperidin-1-yl)-N-[3-(pyridine-2-carbonylamino)-1-adamantyl]pyridine-2-carboxamide
SMILESO=C(NC12CC3CC(C1)CC(NC(=O)c1cccc(N4CCC(O)CC4)n1)(C3)C2)c1ccccn1
InChIInChI=1S/C27H33N5O3/c33-20-7-10-32(11-8-20)23-6-3-5-22(29-23)25(35)31-27-15-18-12-19(16-27)14-26(13-18,17-27)30-24(34)21-4-1-2-9-28-21/h1-6,9,18-20,33H,7-8,10-17H2,(H,30,34)(H,31,35)
InChIKeyFVWICULACSXJES-UHFFFAOYSA-N
MW475.59 g/mol
LogP2.69
Rot. Bonds5

About 6-(4-hydroxypiperidin-1-yl)-N-[3-(pyridine-2-carbonylamino)-1-adamantyl]pyridine-2-carboxamide

6-(4-hydroxypiperidin-1-yl)-N-[3-(pyridine-2-carbonylamino)-1-adamantyl]pyridine-2-carboxamide (PubChem CID 58358655) has the molecular formula C27H33N5O3 and a molecular weight of 475.59 g/mol. Its IUPAC name is 6-(4-hydroxypiperidin-1-yl)-N-[3-(pyridine-2-carbonylamino)-1-adamantyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(4-hydroxypiperidin-1-yl)-N-[3-(pyridine-2-carbonylamino)-1-adamantyl]pyridine-2-carboxamide
PubChem CID58358655
Molecular FormulaC27H33N5O3
Molecular Weight475.59 g/mol
Exact Mass475.26
IUPAC Name6-(4-hydroxypiperidin-1-yl)-N-[3-(pyridine-2-carbonylamino)-1-adamantyl]pyridine-2-carboxamide
SMILESO=C(NC12CC3CC(C1)CC(NC(=O)c1cccc(N4CCC(O)CC4)n1)(C3)C2)c1ccccn1
InChIInChI=1S/C27H33N5O3/c33-20-7-10-32(11-8-20)23-6-3-5-22(29-23)25(35)31-27-15-18-12-19(16-27)14-26(13-18,17-27)30-24(34)21-4-1-2-9-28-21/h1-6,9,18-20,33H,7-8,10-17H2,(H,30,34)(H,31,35)
InChIKeyFVWICULACSXJES-UHFFFAOYSA-N
XLogP2.69
TPSA107.45 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500475.59
LogP ≤ 52.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 6-(4-hydroxypiperidin-1-yl)-N-[3-(pyridine-2-carbonylamino)-1-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-methylpiperazin-1-yl)-N-[3-(pyridine-2-carbonylamino)-1-adamantyl]pyridine-2-carboxamide
CID 58358484
6-[3-(dimethylamino)pyrrolidin-1-yl]-N-[3-(pyridine-2-carbonylamino)-1-adamantyl]pyridine-2-carboxamide
CID 58358543
6-(2-acetamidoethylamino)-N-[3-(pyridine-2-carbonylamino)-1-adamantyl]pyridine-2-carboxamide
CID 59161109
N-[3-(pyridine-2-carbonylamino)-1-adamantyl]-6-(trifluoromethyl)pyrazine-2-carboxamide
CID 59161064
N-(5-hydroxy-2-adamantyl)-6-(4-pyridin-2-ylpiperidin-1-yl)pyridine-2-carboxamide
CID 54591981
N-[3-[(4-bromopyridine-2-carbonyl)amino]-1-adamantyl]-6-methylpyridine-2-carboxamide
CID 58358628
6-ethenyl-N-[3-(pyridine-4-carbonylamino)-1-adamantyl]pyridine-2-carboxamide
CID 163795601
N-(3-amino-1-adamantyl)-6-fluoropyridine-2-carboxamide
CID 67480683
N-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-(4-pyridin-2-ylpiperazin-1-yl)-1,3-thiazole-4-carboxamide
CID 59332171
6-methyl-N-[3-(oxan-4-ylmethylamino)-1-adamantyl]pyridine-2-carboxamide
CID 123657933
[3-[(6-methylpyridine-2-carbonyl)amino]-1-adamantyl] azetidine-1-carboxylate
CID 53327442
N-[4-[4-[[4-(4-hydroxypiperidin-1-yl)benzoyl]amino]benzoyl]phenyl]pyridine-2-carboxamide
CID 67112599

Frequently Asked Questions

What is the IUPAC name of 6-(4-hydroxypiperidin-1-yl)-N-[3-(pyridine-2-carbonylamino)-1-adamantyl]pyridine-2-carboxamide?
The IUPAC name of 6-(4-hydroxypiperidin-1-yl)-N-[3-(pyridine-2-carbonylamino)-1-adamantyl]pyridine-2-carboxamide (CID 58358655) is 6-(4-hydroxypiperidin-1-yl)-N-[3-(pyridine-2-carbonylamino)-1-adamantyl]pyridine-2-carboxamide.
What is the SMILES notation for 6-(4-hydroxypiperidin-1-yl)-N-[3-(pyridine-2-carbonylamino)-1-adamantyl]pyridine-2-carboxamide?
The canonical SMILES for 6-(4-hydroxypiperidin-1-yl)-N-[3-(pyridine-2-carbonylamino)-1-adamantyl]pyridine-2-carboxamide is O=C(NC12CC3CC(C1)CC(NC(=O)c1cccc(N4CCC(O)CC4)n1)(C3)C2)c1ccccn1.
What is the InChIKey of 6-(4-hydroxypiperidin-1-yl)-N-[3-(pyridine-2-carbonylamino)-1-adamantyl]pyridine-2-carboxamide?
The InChIKey is FVWICULACSXJES-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H33N5O3/c33-20-7-10-32(11-8-20)23-6-3-5-22(29-23)25(35)31-27-15-18-12-19(16-27)14-26(13-18,17-27)30-24(34)21-4-1-2-9-28-21/h1-6,9,18-20,33H,7-8,10-17H2,(H,30,34)(H,31,35).
What are the key properties of 6-(4-hydroxypiperidin-1-yl)-N-[3-(pyridine-2-carbonylamino)-1-adamantyl]pyridine-2-carboxamide?
6-(4-hydroxypiperidin-1-yl)-N-[3-(pyridine-2-carbonylamino)-1-adamantyl]pyridine-2-carboxamide has a molecular weight of 475.59 g/mol, XLogP of 2.69, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-hydroxypiperidin-1-yl)-N-[3-(pyridine-2-carbonylamino)-1-adamantyl]pyridine-2-carboxamide is sourced from PubChem (CID 58358655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).