N-(2-hydroxycyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide

C13H15F3N2O2 — CID 62359230

IUPACN-(2-hydroxycyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESO=C(NC1CCCCC1O)c1ccc(C(F)(F)F)nc1
InChIInChI=1S/C13H15F3N2O2/c14-13(15,16)11-6-5-8(7-17-11)12(20)18-9-3-1-2-4-10(9)19/h5-7,9-10,19H,1-4H2,(H,18,20)
InChIKeyHTADLHNLUBEADF-UHFFFAOYSA-N
MW288.27 g/mol
LogP2.13
Rot. Bonds2

About N-(2-hydroxycyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide

N-(2-hydroxycyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide (PubChem CID 62359230) has the molecular formula C13H15F3N2O2 and a molecular weight of 288.27 g/mol. Its IUPAC name is N-(2-hydroxycyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxycyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide
PubChem CID62359230
Molecular FormulaC13H15F3N2O2
Molecular Weight288.27 g/mol
Exact Mass288.11
IUPAC NameN-(2-hydroxycyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESO=C(NC1CCCCC1O)c1ccc(C(F)(F)F)nc1
InChIInChI=1S/C13H15F3N2O2/c14-13(15,16)11-6-5-8(7-17-11)12(20)18-9-3-1-2-4-10(9)19/h5-7,9-10,19H,1-4H2,(H,18,20)
InChIKeyHTADLHNLUBEADF-UHFFFAOYSA-N
XLogP2.13
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.27
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxycyclobutyl)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 126856476
N-[(3S)-oxan-3-yl]-6-(trifluoromethyl)pyridine-3-carboxamide
CID 124606510
N-[(1R,2R)-2-hydroxycyclohexyl]pyridazine-4-carboxamide
CID 104927784
6-methyl-N-[(1S,2R)-2-(trifluoromethyl)cyclohexyl]pyridine-3-carboxamide
CID 52501616
N-[2-(cycloheptylamino)ethyl]-6-(trifluoromethyl)pyridine-3-carboxamide;dihydrochloride
CID 119620729
N-(1,2,3,4-tetrahydronaphthalen-2-yl)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 22318683
6-tert-butyl-N-cyclohexylpyridine-3-carboxamide
CID 20709646
N-[2-[(3-butylpiperidin-1-yl)methyl]cyclohexyl]-6-(trifluoromethyl)pyridine-3-carboxamide
CID 69089206
N-[(2S,3S)-2-(1-methylimidazol-2-yl)oxolan-3-yl]-6-(trifluoromethyl)pyridine-3-carboxamide
CID 128986100
6-(trifluoromethyl)pyridine-3-carbohydrazide;dihydrochloride
CID 175168012
N-(2-hydroxycyclohexyl)-4-iodobenzamide
CID 62365415
4-chloro-N-[(1R,2R)-2-hydroxycyclohexyl]benzamide
CID 40617766

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxycyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide?
The IUPAC name of N-(2-hydroxycyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide (CID 62359230) is N-(2-hydroxycyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-hydroxycyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide?
The canonical SMILES for N-(2-hydroxycyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide is O=C(NC1CCCCC1O)c1ccc(C(F)(F)F)nc1.
What is the InChIKey of N-(2-hydroxycyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide?
The InChIKey is HTADLHNLUBEADF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15F3N2O2/c14-13(15,16)11-6-5-8(7-17-11)12(20)18-9-3-1-2-4-10(9)19/h5-7,9-10,19H,1-4H2,(H,18,20).
What are the key properties of N-(2-hydroxycyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide?
N-(2-hydroxycyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide has a molecular weight of 288.27 g/mol, XLogP of 2.13, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxycyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide is sourced from PubChem (CID 62359230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).