(3-methylsulfonylcyclohexyl)-pyrazolo[1,5-a]pyridin-3-ylmethanol

C15H20N2O3S — CID 103129058

IUPAC(3-methylsulfonylcyclohexyl)-pyrazolo[1,5-a]pyridin-3-ylmethanol
SMILESCS(=O)(=O)C1CCCC(C(O)c2cnn3ccccc23)C1
InChIInChI=1S/C15H20N2O3S/c1-21(19,20)12-6-4-5-11(9-12)15(18)13-10-16-17-8-3-2-7-14(13)17/h2-3,7-8,10-12,15,18H,4-6,9H2,1H3
InChIKeyXKTJKZAYOXIOHA-UHFFFAOYSA-N
MW308.40 g/mol
LogP1.97
Rot. Bonds3

About (3-methylsulfonylcyclohexyl)-pyrazolo[1,5-a]pyridin-3-ylmethanol

(3-methylsulfonylcyclohexyl)-pyrazolo[1,5-a]pyridin-3-ylmethanol (PubChem CID 103129058) has the molecular formula C15H20N2O3S and a molecular weight of 308.40 g/mol. Its IUPAC name is (3-methylsulfonylcyclohexyl)-pyrazolo[1,5-a]pyridin-3-ylmethanol.

Molecular Properties

Compound Name(3-methylsulfonylcyclohexyl)-pyrazolo[1,5-a]pyridin-3-ylmethanol
PubChem CID103129058
Molecular FormulaC15H20N2O3S
Molecular Weight308.40 g/mol
Exact Mass308.12
IUPAC Name(3-methylsulfonylcyclohexyl)-pyrazolo[1,5-a]pyridin-3-ylmethanol
SMILESCS(=O)(=O)C1CCCC(C(O)c2cnn3ccccc23)C1
InChIInChI=1S/C15H20N2O3S/c1-21(19,20)12-6-4-5-11(9-12)15(18)13-10-16-17-8-3-2-7-14(13)17/h2-3,7-8,10-12,15,18H,4-6,9H2,1H3
InChIKeyXKTJKZAYOXIOHA-UHFFFAOYSA-N
XLogP1.97
TPSA71.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.40
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3-bromo-2-methylphenyl)-(3-methylsulfonylcyclohexyl)methanol
CID 115822100
(4-bromo-2-methylphenyl)-(3-methylsulfonylcyclohexyl)methanol
CID 115822026
N-methyl-1-(3-methylcyclohexyl)-1-pyrazolo[1,5-a]pyridin-3-ylmethanamine
CID 103127395
(2-amino-5-bromophenyl)-(3-methylsulfonylcyclohexyl)methanol
CID 82703710
(2-bromo-4-fluorophenyl)-(3-methylsulfonylcyclohexyl)methanol
CID 115822082
(3-chloro-2-pyridinyl)-(3-methylsulfonylcyclohexyl)methanol
CID 103443446
(2,6-dimethyl-4-pyridinyl)-(3-methylsulfonylcyclohexyl)methanol
CID 107502764
(2,5-dichlorothiophen-3-yl)-(3-methylsulfonylcyclohexyl)methanol
CID 107969794
(5-methyl-3-pyridinyl)-(3-methylsulfonylcyclohexyl)methanol
CID 105114882
(4-bromo-3,5-dimethylphenyl)-(3-methylsulfonylcyclohexyl)methanol
CID 114329804
cyclooctyl-(3-methylsulfonylcyclohexyl)methanol
CID 80604080
ethane;3-propan-2-ylpyrazolo[1,5-a]pyridine
CID 155742340

Frequently Asked Questions

What is the IUPAC name of (3-methylsulfonylcyclohexyl)-pyrazolo[1,5-a]pyridin-3-ylmethanol?
The IUPAC name of (3-methylsulfonylcyclohexyl)-pyrazolo[1,5-a]pyridin-3-ylmethanol (CID 103129058) is (3-methylsulfonylcyclohexyl)-pyrazolo[1,5-a]pyridin-3-ylmethanol.
What is the SMILES notation for (3-methylsulfonylcyclohexyl)-pyrazolo[1,5-a]pyridin-3-ylmethanol?
The canonical SMILES for (3-methylsulfonylcyclohexyl)-pyrazolo[1,5-a]pyridin-3-ylmethanol is CS(=O)(=O)C1CCCC(C(O)c2cnn3ccccc23)C1.
What is the InChIKey of (3-methylsulfonylcyclohexyl)-pyrazolo[1,5-a]pyridin-3-ylmethanol?
The InChIKey is XKTJKZAYOXIOHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3S/c1-21(19,20)12-6-4-5-11(9-12)15(18)13-10-16-17-8-3-2-7-14(13)17/h2-3,7-8,10-12,15,18H,4-6,9H2,1H3.
What are the key properties of (3-methylsulfonylcyclohexyl)-pyrazolo[1,5-a]pyridin-3-ylmethanol?
(3-methylsulfonylcyclohexyl)-pyrazolo[1,5-a]pyridin-3-ylmethanol has a molecular weight of 308.40 g/mol, XLogP of 1.97, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methylsulfonylcyclohexyl)-pyrazolo[1,5-a]pyridin-3-ylmethanol is sourced from PubChem (CID 103129058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).