1-(3-ethylcyclohexyl)-2-(1-methylpyrazol-3-yl)ethanol

C14H24N2O — CID 82870233

IUPAC1-(3-ethylcyclohexyl)-2-(1-methylpyrazol-3-yl)ethanol
SMILESCCC1CCCC(C(O)Cc2ccn(C)n2)C1
InChIInChI=1S/C14H24N2O/c1-3-11-5-4-6-12(9-11)14(17)10-13-7-8-16(2)15-13/h7-8,11-12,14,17H,3-6,9-10H2,1-2H3
InChIKeyWLLJYIPFPOCVFR-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.54
Rot. Bonds4

About 1-(3-ethylcyclohexyl)-2-(1-methylpyrazol-3-yl)ethanol

1-(3-ethylcyclohexyl)-2-(1-methylpyrazol-3-yl)ethanol (PubChem CID 82870233) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 1-(3-ethylcyclohexyl)-2-(1-methylpyrazol-3-yl)ethanol.

Molecular Properties

Compound Name1-(3-ethylcyclohexyl)-2-(1-methylpyrazol-3-yl)ethanol
PubChem CID82870233
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name1-(3-ethylcyclohexyl)-2-(1-methylpyrazol-3-yl)ethanol
SMILESCCC1CCCC(C(O)Cc2ccn(C)n2)C1
InChIInChI=1S/C14H24N2O/c1-3-11-5-4-6-12(9-11)14(17)10-13-7-8-16(2)15-13/h7-8,11-12,14,17H,3-6,9-10H2,1-2H3
InChIKeyWLLJYIPFPOCVFR-UHFFFAOYSA-N
XLogP2.54
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-ethylcyclohexyl)-2-(1-methylpyrazol-3-yl)ethanone
CID 82868647
2-(1-cyclopentylpyrazol-3-yl)-1-(4-ethylcyclohexyl)ethanol
CID 65393519
2-cyclobutyl-1-(3-ethylcyclohexyl)ethanol
CID 65457880
(3-ethylcyclohexyl)-(3-methylimidazol-4-yl)methanol
CID 66117130
[1-cyclohexyl-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105201792
1-(3-ethyl-1,4-dithian-2-yl)-2-(1-methylpyrazol-3-yl)ethanol
CID 82877907
4-ethyl-1-[(1-methylpyrazol-3-yl)methyl]cycloheptan-1-ol
CID 82869439
1-cyclopropyl-3-(1-methylpyrazol-3-yl)propan-2-amine
CID 82876061
1-cyclohexyl-2-(1-propan-2-ylpyrazol-3-yl)ethanol
CID 64770987
(3-ethylcyclohexyl)-(1-methylimidazol-2-yl)methanol
CID 65400333
1-cyclopropyl-N-ethyl-3-(1-methylpyrazol-3-yl)propan-2-amine
CID 82876237
1-(3-ethylcyclohexyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-ol
CID 105104488

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethylcyclohexyl)-2-(1-methylpyrazol-3-yl)ethanol?
The IUPAC name of 1-(3-ethylcyclohexyl)-2-(1-methylpyrazol-3-yl)ethanol (CID 82870233) is 1-(3-ethylcyclohexyl)-2-(1-methylpyrazol-3-yl)ethanol.
What is the SMILES notation for 1-(3-ethylcyclohexyl)-2-(1-methylpyrazol-3-yl)ethanol?
The canonical SMILES for 1-(3-ethylcyclohexyl)-2-(1-methylpyrazol-3-yl)ethanol is CCC1CCCC(C(O)Cc2ccn(C)n2)C1.
What is the InChIKey of 1-(3-ethylcyclohexyl)-2-(1-methylpyrazol-3-yl)ethanol?
The InChIKey is WLLJYIPFPOCVFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-3-11-5-4-6-12(9-11)14(17)10-13-7-8-16(2)15-13/h7-8,11-12,14,17H,3-6,9-10H2,1-2H3.
What are the key properties of 1-(3-ethylcyclohexyl)-2-(1-methylpyrazol-3-yl)ethanol?
1-(3-ethylcyclohexyl)-2-(1-methylpyrazol-3-yl)ethanol has a molecular weight of 236.36 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethylcyclohexyl)-2-(1-methylpyrazol-3-yl)ethanol is sourced from PubChem (CID 82870233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).