2-(1-cyclohexylpyrazol-3-yl)-1-(3-methyl-2-pyridinyl)ethanol

C17H23N3O — CID 64785093

IUPAC2-(1-cyclohexylpyrazol-3-yl)-1-(3-methyl-2-pyridinyl)ethanol
SMILESCc1cccnc1C(O)Cc1ccn(C2CCCCC2)n1
InChIInChI=1S/C17H23N3O/c1-13-6-5-10-18-17(13)16(21)12-14-9-11-20(19-14)15-7-3-2-4-8-15/h5-6,9-11,15-16,21H,2-4,7-8,12H2,1H3
InChIKeyMULXWDKODGDYKN-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.37
Rot. Bonds4

About 2-(1-cyclohexylpyrazol-3-yl)-1-(3-methyl-2-pyridinyl)ethanol

2-(1-cyclohexylpyrazol-3-yl)-1-(3-methyl-2-pyridinyl)ethanol (PubChem CID 64785093) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is 2-(1-cyclohexylpyrazol-3-yl)-1-(3-methyl-2-pyridinyl)ethanol.

Molecular Properties

Compound Name2-(1-cyclohexylpyrazol-3-yl)-1-(3-methyl-2-pyridinyl)ethanol
PubChem CID64785093
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name2-(1-cyclohexylpyrazol-3-yl)-1-(3-methyl-2-pyridinyl)ethanol
SMILESCc1cccnc1C(O)Cc1ccn(C2CCCCC2)n1
InChIInChI=1S/C17H23N3O/c1-13-6-5-10-18-17(13)16(21)12-14-9-11-20(19-14)15-7-3-2-4-8-15/h5-6,9-11,15-16,21H,2-4,7-8,12H2,1H3
InChIKeyMULXWDKODGDYKN-UHFFFAOYSA-N
XLogP3.37
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-methyl-2-pyridinyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol
CID 64771004
2-(1-cyclohexylpyrazol-3-yl)-1-(1-methylimidazol-4-yl)ethanol
CID 107978417
2-(1-cyclohexylpyrazol-3-yl)-1-(3-methyl-2-pyridinyl)ethanone
CID 64784881
[2-(1-cyclopentylpyrazol-3-yl)-1-pyrimidin-2-ylethyl]hydrazine
CID 105203635
2-(1-cyclohexylpyrazol-3-yl)-1-(2,5-dimethylpyrazol-3-yl)ethanol
CID 105102425
1-(2-bromophenyl)-2-(1-cyclohexylpyrazol-3-yl)ethanol
CID 64786012
2-(1-cyclohexylpyrazol-3-yl)-1-(2-iodophenyl)ethanol
CID 115805134
2-(1-cyclohexylpyrazol-3-yl)-1-(5-methyl-3-pyridinyl)ethanol
CID 105102376
1-(4-bromophenyl)-2-(1-cyclohexylpyrazol-3-yl)ethanol
CID 64784262
2-(1-cyclopentylpyrazol-3-yl)-N-ethyl-1-pyrimidin-2-ylethanamine
CID 64778210
3-(1-cyclopentylpyrazol-3-yl)-1,1-diethoxypropan-2-ol
CID 79495174
1-(4-bromophenyl)-2-(1-cyclopentylpyrazol-3-yl)ethanol
CID 64784263

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclohexylpyrazol-3-yl)-1-(3-methyl-2-pyridinyl)ethanol?
The IUPAC name of 2-(1-cyclohexylpyrazol-3-yl)-1-(3-methyl-2-pyridinyl)ethanol (CID 64785093) is 2-(1-cyclohexylpyrazol-3-yl)-1-(3-methyl-2-pyridinyl)ethanol.
What is the SMILES notation for 2-(1-cyclohexylpyrazol-3-yl)-1-(3-methyl-2-pyridinyl)ethanol?
The canonical SMILES for 2-(1-cyclohexylpyrazol-3-yl)-1-(3-methyl-2-pyridinyl)ethanol is Cc1cccnc1C(O)Cc1ccn(C2CCCCC2)n1.
What is the InChIKey of 2-(1-cyclohexylpyrazol-3-yl)-1-(3-methyl-2-pyridinyl)ethanol?
The InChIKey is MULXWDKODGDYKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-13-6-5-10-18-17(13)16(21)12-14-9-11-20(19-14)15-7-3-2-4-8-15/h5-6,9-11,15-16,21H,2-4,7-8,12H2,1H3.
What are the key properties of 2-(1-cyclohexylpyrazol-3-yl)-1-(3-methyl-2-pyridinyl)ethanol?
2-(1-cyclohexylpyrazol-3-yl)-1-(3-methyl-2-pyridinyl)ethanol has a molecular weight of 285.39 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclohexylpyrazol-3-yl)-1-(3-methyl-2-pyridinyl)ethanol is sourced from PubChem (CID 64785093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).