2-cyclohexyl-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methoxyethanol

C15H26N2O3 — CID 114645947

IUPAC2-cyclohexyl-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methoxyethanol
SMILESCCn1ncc(OC)c1C(O)C(OC)C1CCCCC1
InChIInChI=1S/C15H26N2O3/c1-4-17-13(12(19-2)10-16-17)14(18)15(20-3)11-8-6-5-7-9-11/h10-11,14-15,18H,4-9H2,1-3H3
InChIKeyGTTPAJGMRVTBFJ-UHFFFAOYSA-N
MW282.38 g/mol
LogP2.54
Rot. Bonds6

About 2-cyclohexyl-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methoxyethanol

2-cyclohexyl-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methoxyethanol (PubChem CID 114645947) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is 2-cyclohexyl-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methoxyethanol.

Molecular Properties

Compound Name2-cyclohexyl-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methoxyethanol
PubChem CID114645947
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Name2-cyclohexyl-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methoxyethanol
SMILESCCn1ncc(OC)c1C(O)C(OC)C1CCCCC1
InChIInChI=1S/C15H26N2O3/c1-4-17-13(12(19-2)10-16-17)14(18)15(20-3)11-8-6-5-7-9-11/h10-11,14-15,18H,4-9H2,1-3H3
InChIKeyGTTPAJGMRVTBFJ-UHFFFAOYSA-N
XLogP2.54
TPSA56.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-cycloheptyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanol
CID 115837192
1-(1-ethyl-4-methoxypyrazol-5-yl)-2,2-dimethoxyethanol
CID 114636558
7-bicyclo[4.1.0]heptanyl-(1-ethyl-4-methoxypyrazol-5-yl)methanol
CID 115837191
1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methylbutan-1-ol
CID 114635185
[2-cycloheptyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethyl]hydrazine
CID 105339349
2-cyclohexyl-2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanamine
CID 114662095
(1-ethyl-4-methoxypyrazol-5-yl)-(thiolan-3-yl)methanol
CID 105130248
1-(4-chloro-1-ethylpyrazol-5-yl)-2-cyclohexylethane-1,2-diol
CID 103459014
[2-cyclobutyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethyl]hydrazine
CID 103170830
(1-ethyl-4-methoxypyrazol-5-yl)-(2-ethyloxolan-3-yl)methanol
CID 114104696
2-ethoxy-1-(1-ethyl-4-methoxypyrazol-5-yl)-3,3-dimethylbutan-1-ol
CID 114645711
1,4-dioxan-2-yl-(1-ethyl-4-methoxypyrazol-5-yl)methanol
CID 115837206

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methoxyethanol?
The IUPAC name of 2-cyclohexyl-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methoxyethanol (CID 114645947) is 2-cyclohexyl-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methoxyethanol.
What is the SMILES notation for 2-cyclohexyl-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methoxyethanol?
The canonical SMILES for 2-cyclohexyl-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methoxyethanol is CCn1ncc(OC)c1C(O)C(OC)C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methoxyethanol?
The InChIKey is GTTPAJGMRVTBFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-4-17-13(12(19-2)10-16-17)14(18)15(20-3)11-8-6-5-7-9-11/h10-11,14-15,18H,4-9H2,1-3H3.
What are the key properties of 2-cyclohexyl-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methoxyethanol?
2-cyclohexyl-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methoxyethanol has a molecular weight of 282.38 g/mol, XLogP of 2.54, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methoxyethanol is sourced from PubChem (CID 114645947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).