2-cycloheptyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanol

C15H26N2O2 — CID 115837192

IUPAC2-cycloheptyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanol
SMILESCCn1ncc(OC)c1C(O)CC1CCCCCC1
InChIInChI=1S/C15H26N2O2/c1-3-17-15(14(19-2)11-16-17)13(18)10-12-8-6-4-5-7-9-12/h11-13,18H,3-10H2,1-2H3
InChIKeyMXCODRCBVAYJRR-UHFFFAOYSA-N
MW266.38 g/mol
LogP3.31
Rot. Bonds5

About 2-cycloheptyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanol

2-cycloheptyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanol (PubChem CID 115837192) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 2-cycloheptyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanol.

Molecular Properties

Compound Name2-cycloheptyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanol
PubChem CID115837192
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name2-cycloheptyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanol
SMILESCCn1ncc(OC)c1C(O)CC1CCCCCC1
InChIInChI=1S/C15H26N2O2/c1-3-17-15(14(19-2)11-16-17)13(18)10-12-8-6-4-5-7-9-12/h11-13,18H,3-10H2,1-2H3
InChIKeyMXCODRCBVAYJRR-UHFFFAOYSA-N
XLogP3.31
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-cycloheptyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethyl]hydrazine
CID 105339349
1-(4-bromo-1-ethylpyrazol-5-yl)-2-cyclohexylethanol
CID 114637053
[2-cyclobutyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethyl]hydrazine
CID 103170830
2-cyclohexyl-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methoxyethanol
CID 114645947
1-(4-methoxy-1-propylpyrazol-5-yl)-2-(thian-4-yl)ethanol
CID 105130487
7-bicyclo[4.1.0]heptanyl-(1-ethyl-4-methoxypyrazol-5-yl)methanol
CID 115837191
2-(dimethylamino)-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanol
CID 114644642
1-(1-ethyl-4-methoxypyrazol-5-yl)-2-(4-methoxyphenyl)ethanol
CID 114643108
1-(1-ethyl-4-methoxypyrazol-5-yl)-2-[(2-methylpropan-2-yl)oxy]ethanol
CID 105130141
(1-ethyl-4-methoxypyrazol-5-yl)-pyridin-4-ylmethanol
CID 114634373
3-(dimethylamino)-1-(1-ethyl-4-methoxypyrazol-5-yl)propan-1-ol
CID 114645183
1-(1-ethyl-4-methoxypyrazol-5-yl)-3-phenylpropan-1-ol
CID 114635552

Frequently Asked Questions

What is the IUPAC name of 2-cycloheptyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanol?
The IUPAC name of 2-cycloheptyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanol (CID 115837192) is 2-cycloheptyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanol.
What is the SMILES notation for 2-cycloheptyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanol?
The canonical SMILES for 2-cycloheptyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanol is CCn1ncc(OC)c1C(O)CC1CCCCCC1.
What is the InChIKey of 2-cycloheptyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanol?
The InChIKey is MXCODRCBVAYJRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-3-17-15(14(19-2)11-16-17)13(18)10-12-8-6-4-5-7-9-12/h11-13,18H,3-10H2,1-2H3.
What are the key properties of 2-cycloheptyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanol?
2-cycloheptyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanol has a molecular weight of 266.38 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cycloheptyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanol is sourced from PubChem (CID 115837192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).