2-cyclopropyl-N-(5-hydroxy-2-adamantyl)-6-methylpyridine-3-carboxamide

C20H26N2O2 — CID 71451376

IUPAC2-cyclopropyl-N-(5-hydroxy-2-adamantyl)-6-methylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)NC2C3CC4CC2CC(O)(C4)C3)c(C2CC2)n1
InChIInChI=1S/C20H26N2O2/c1-11-2-5-16(18(21-11)13-3-4-13)19(23)22-17-14-6-12-7-15(17)10-20(24,8-12)9-14/h2,5,12-15,17,24H,3-4,6-10H2,1H3,(H,22,23)
InChIKeyODVXHPCEKQSWPZ-UHFFFAOYSA-N
MW326.44 g/mol
LogP2.94
Rot. Bonds3

About 2-cyclopropyl-N-(5-hydroxy-2-adamantyl)-6-methylpyridine-3-carboxamide

2-cyclopropyl-N-(5-hydroxy-2-adamantyl)-6-methylpyridine-3-carboxamide (PubChem CID 71451376) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is 2-cyclopropyl-N-(5-hydroxy-2-adamantyl)-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-cyclopropyl-N-(5-hydroxy-2-adamantyl)-6-methylpyridine-3-carboxamide
PubChem CID71451376
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC Name2-cyclopropyl-N-(5-hydroxy-2-adamantyl)-6-methylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)NC2C3CC4CC2CC(O)(C4)C3)c(C2CC2)n1
InChIInChI=1S/C20H26N2O2/c1-11-2-5-16(18(21-11)13-3-4-13)19(23)22-17-14-6-12-7-15(17)10-20(24,8-12)9-14/h2,5,12-15,17,24H,3-4,6-10H2,1H3,(H,22,23)
InChIKeyODVXHPCEKQSWPZ-UHFFFAOYSA-N
XLogP2.94
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-hydroxy-2-adamantyl)-6-methyl-2-propylsulfanylpyridine-3-carboxamide
CID 71456704
2-cyclopropyl-N-(5-hydroxy-2-adamantyl)-6-morpholin-4-ylpyridine-3-carboxamide
CID 71456705
N-[(2S)-2-aminospiro[2.5]octan-6-yl]-6-methyl-2-propan-2-ylpyridine-3-carboxamide
CID 164635907
3-ethyl-5-(4-fluorobenzoyl)-N-(5-hydroxy-2-adamantyl)-1-methylpyrrole-2-carboxamide
CID 56940748
5-(4-fluorobenzoyl)-N-(5-hydroxy-2-adamantyl)-1-methyl-3-propylpyrrole-2-carboxamide
CID 56940750
5-(2-fluorobenzoyl)-N-(5-hydroxy-2-adamantyl)-1-methyl-3-propylpyrrole-2-carboxamide
CID 56940897
5-(3,4-difluorobenzoyl)-N-(5-hydroxy-2-adamantyl)-1,3-dimethylpyrrole-2-carboxamide
CID 56940898
3-ethyl-5-(2-fluoro-5-methylbenzoyl)-N-(5-hydroxy-2-adamantyl)-1-methylpyrrole-2-carboxamide
CID 56940901
5-(3,4-difluorobenzoyl)-3-ethyl-N-(5-hydroxy-2-adamantyl)-1-methylpyrrole-2-carboxamide
CID 56941032
3-ethyl-5-(3-fluorobenzoyl)-N-(5-hydroxy-2-adamantyl)-1-methylpyrrole-2-carboxamide
CID 56941035
5-(2,3-difluorobenzoyl)-N-(5-hydroxy-2-adamantyl)-1-methyl-3-propylpyrrole-2-carboxamide
CID 56941036
5-(2,4-difluorobenzoyl)-N-(5-hydroxy-2-adamantyl)-1,3-dimethylpyrrole-2-carboxamide
CID 56941037

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(5-hydroxy-2-adamantyl)-6-methylpyridine-3-carboxamide?
The IUPAC name of 2-cyclopropyl-N-(5-hydroxy-2-adamantyl)-6-methylpyridine-3-carboxamide (CID 71451376) is 2-cyclopropyl-N-(5-hydroxy-2-adamantyl)-6-methylpyridine-3-carboxamide.
What is the SMILES notation for 2-cyclopropyl-N-(5-hydroxy-2-adamantyl)-6-methylpyridine-3-carboxamide?
The canonical SMILES for 2-cyclopropyl-N-(5-hydroxy-2-adamantyl)-6-methylpyridine-3-carboxamide is Cc1ccc(C(=O)NC2C3CC4CC2CC(O)(C4)C3)c(C2CC2)n1.
What is the InChIKey of 2-cyclopropyl-N-(5-hydroxy-2-adamantyl)-6-methylpyridine-3-carboxamide?
The InChIKey is ODVXHPCEKQSWPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O2/c1-11-2-5-16(18(21-11)13-3-4-13)19(23)22-17-14-6-12-7-15(17)10-20(24,8-12)9-14/h2,5,12-15,17,24H,3-4,6-10H2,1H3,(H,22,23).
What are the key properties of 2-cyclopropyl-N-(5-hydroxy-2-adamantyl)-6-methylpyridine-3-carboxamide?
2-cyclopropyl-N-(5-hydroxy-2-adamantyl)-6-methylpyridine-3-carboxamide has a molecular weight of 326.44 g/mol, XLogP of 2.94, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(5-hydroxy-2-adamantyl)-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 71451376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).