2-cyclohexyl-1-(1-methylpyrazol-4-yl)ethanol

C12H20N2O — CID 61088408

IUPAC2-cyclohexyl-1-(1-methylpyrazol-4-yl)ethanol
SMILESCn1cc(C(O)CC2CCCCC2)cn1
InChIInChI=1S/C12H20N2O/c1-14-9-11(8-13-14)12(15)7-10-5-3-2-4-6-10/h8-10,12,15H,2-7H2,1H3
InChIKeyXQGNDYOEMATTJO-UHFFFAOYSA-N
MW208.31 g/mol
LogP2.42
Rot. Bonds3

About 2-cyclohexyl-1-(1-methylpyrazol-4-yl)ethanol

2-cyclohexyl-1-(1-methylpyrazol-4-yl)ethanol (PubChem CID 61088408) has the molecular formula C12H20N2O and a molecular weight of 208.31 g/mol. Its IUPAC name is 2-cyclohexyl-1-(1-methylpyrazol-4-yl)ethanol.

Molecular Properties

Compound Name2-cyclohexyl-1-(1-methylpyrazol-4-yl)ethanol
PubChem CID61088408
Molecular FormulaC12H20N2O
Molecular Weight208.31 g/mol
Exact Mass208.16
IUPAC Name2-cyclohexyl-1-(1-methylpyrazol-4-yl)ethanol
SMILESCn1cc(C(O)CC2CCCCC2)cn1
InChIInChI=1S/C12H20N2O/c1-14-9-11(8-13-14)12(15)7-10-5-3-2-4-6-10/h8-10,12,15H,2-7H2,1H3
InChIKeyXQGNDYOEMATTJO-UHFFFAOYSA-N
XLogP2.42
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclohexyl-N-methyl-1-(1-methylpyrazol-4-yl)ethanamine
CID 43485883
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CID 103027790
1-(1-methylpyrazol-4-yl)-2-[1-(piperidin-3-ylmethyl)pyrrolidin-2-yl]ethanol
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1-cyclopentyl-3-(1-methylpyrazol-4-yl)oxypropan-2-ol
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[3-cyclopentyl-1-(1-methylpyrazol-4-yl)propyl]hydrazine
CID 105288733
1-(4-chloro-1-methylpyrazol-5-yl)-2-cycloheptylethanol
CID 115836779
2-cyclohexyl-1-pyridin-4-ylethanol
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2-cyclohexyl-1-(2,6-dimethyl-4-pyridinyl)ethanol
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2-cyclohexyl-1-pyridin-3-ylethanol
CID 22768104
1-(cyclohexylmethoxy)-1-(1-methylpyrazol-4-yl)propan-2-amine
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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-(1-methylpyrazol-4-yl)ethanol?
The IUPAC name of 2-cyclohexyl-1-(1-methylpyrazol-4-yl)ethanol (CID 61088408) is 2-cyclohexyl-1-(1-methylpyrazol-4-yl)ethanol.
What is the SMILES notation for 2-cyclohexyl-1-(1-methylpyrazol-4-yl)ethanol?
The canonical SMILES for 2-cyclohexyl-1-(1-methylpyrazol-4-yl)ethanol is Cn1cc(C(O)CC2CCCCC2)cn1.
What is the InChIKey of 2-cyclohexyl-1-(1-methylpyrazol-4-yl)ethanol?
The InChIKey is XQGNDYOEMATTJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-14-9-11(8-13-14)12(15)7-10-5-3-2-4-6-10/h8-10,12,15H,2-7H2,1H3.
What are the key properties of 2-cyclohexyl-1-(1-methylpyrazol-4-yl)ethanol?
2-cyclohexyl-1-(1-methylpyrazol-4-yl)ethanol has a molecular weight of 208.31 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-(1-methylpyrazol-4-yl)ethanol is sourced from PubChem (CID 61088408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).