N-(2,2-dimethylcyclohexyl)-3-hydroxypyridine-4-carboxamide

C14H20N2O2 — CID 81443518

IUPACN-(2,2-dimethylcyclohexyl)-3-hydroxypyridine-4-carboxamide
SMILESCC1(C)CCCCC1NC(=O)c1ccncc1O
InChIInChI=1S/C14H20N2O2/c1-14(2)7-4-3-5-12(14)16-13(18)10-6-8-15-9-11(10)17/h6,8-9,12,17H,3-5,7H2,1-2H3,(H,16,18)
InChIKeyGGMRPJKQVUJGJX-UHFFFAOYSA-N
MW248.33 g/mol
LogP2.49
Rot. Bonds2

About N-(2,2-dimethylcyclohexyl)-3-hydroxypyridine-4-carboxamide

N-(2,2-dimethylcyclohexyl)-3-hydroxypyridine-4-carboxamide (PubChem CID 81443518) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-(2,2-dimethylcyclohexyl)-3-hydroxypyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2,2-dimethylcyclohexyl)-3-hydroxypyridine-4-carboxamide
PubChem CID81443518
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-(2,2-dimethylcyclohexyl)-3-hydroxypyridine-4-carboxamide
SMILESCC1(C)CCCCC1NC(=O)c1ccncc1O
InChIInChI=1S/C14H20N2O2/c1-14(2)7-4-3-5-12(14)16-13(18)10-6-8-15-9-11(10)17/h6,8-9,12,17H,3-5,7H2,1-2H3,(H,16,18)
InChIKeyGGMRPJKQVUJGJX-UHFFFAOYSA-N
XLogP2.49
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-(2,2-dimethylcyclohexyl)pyridine-4-carboxamide
CID 79877759
4-bromo-N-(2,2-dimethylcyclohexyl)-2-hydroxybenzamide
CID 79878094
N-(2,2-dimethylcyclohexyl)-2-hydroxy-4-methoxybenzamide
CID 79877931
3-hydroxy-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-4-carboxamide
CID 81443107
N-(2-ethylcyclohexyl)-3-hydroxypyridine-4-carboxamide
CID 81443584
3-hydroxy-N-(thian-3-yl)pyridine-4-carboxamide
CID 115696792
2-[(3-fluoropyridine-4-carbonyl)amino]-1-methylcyclopentane-1-carboxylic acid
CID 82760270
N-(2,2-dimethylcyclohexyl)-2-(ethylamino)pyridine-3-carboxamide
CID 79872423
N-cyclopentyloxy-3-hydroxypyridine-4-carboxamide
CID 83218037
N-(2,2-dimethylcyclohexyl)-9-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 136520292
3-bromo-N-(2,2-dimethylcyclohexyl)-2-methylbenzamide
CID 79878594
3,5-diamino-N-(2,2-dimethylcyclohexyl)benzamide
CID 79855552

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylcyclohexyl)-3-hydroxypyridine-4-carboxamide?
The IUPAC name of N-(2,2-dimethylcyclohexyl)-3-hydroxypyridine-4-carboxamide (CID 81443518) is N-(2,2-dimethylcyclohexyl)-3-hydroxypyridine-4-carboxamide.
What is the SMILES notation for N-(2,2-dimethylcyclohexyl)-3-hydroxypyridine-4-carboxamide?
The canonical SMILES for N-(2,2-dimethylcyclohexyl)-3-hydroxypyridine-4-carboxamide is CC1(C)CCCCC1NC(=O)c1ccncc1O.
What is the InChIKey of N-(2,2-dimethylcyclohexyl)-3-hydroxypyridine-4-carboxamide?
The InChIKey is GGMRPJKQVUJGJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-14(2)7-4-3-5-12(14)16-13(18)10-6-8-15-9-11(10)17/h6,8-9,12,17H,3-5,7H2,1-2H3,(H,16,18).
What are the key properties of N-(2,2-dimethylcyclohexyl)-3-hydroxypyridine-4-carboxamide?
N-(2,2-dimethylcyclohexyl)-3-hydroxypyridine-4-carboxamide has a molecular weight of 248.33 g/mol, XLogP of 2.49, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylcyclohexyl)-3-hydroxypyridine-4-carboxamide is sourced from PubChem (CID 81443518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).