[4-[(1-ethylindazol-3-yl)methoxy]cyclohexyl]methanol

C17H24N2O2 — CID 106825216

IUPAC[4-[(1-ethylindazol-3-yl)methoxy]cyclohexyl]methanol
SMILESCCn1nc(COC2CCC(CO)CC2)c2ccccc21
InChIInChI=1S/C17H24N2O2/c1-2-19-17-6-4-3-5-15(17)16(18-19)12-21-14-9-7-13(11-20)8-10-14/h3-6,13-14,20H,2,7-12H2,1H3
InChIKeyWFOGPUXDKVWUGV-UHFFFAOYSA-N
MW288.39 g/mol
LogP3.12
Rot. Bonds5

About [4-[(1-ethylindazol-3-yl)methoxy]cyclohexyl]methanol

[4-[(1-ethylindazol-3-yl)methoxy]cyclohexyl]methanol (PubChem CID 106825216) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is [4-[(1-ethylindazol-3-yl)methoxy]cyclohexyl]methanol.

Molecular Properties

Compound Name[4-[(1-ethylindazol-3-yl)methoxy]cyclohexyl]methanol
PubChem CID106825216
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name[4-[(1-ethylindazol-3-yl)methoxy]cyclohexyl]methanol
SMILESCCn1nc(COC2CCC(CO)CC2)c2ccccc21
InChIInChI=1S/C17H24N2O2/c1-2-19-17-6-4-3-5-15(17)16(18-19)12-21-14-9-7-13(11-20)8-10-14/h3-6,13-14,20H,2,7-12H2,1H3
InChIKeyWFOGPUXDKVWUGV-UHFFFAOYSA-N
XLogP3.12
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [4-[(1-ethylindazol-3-yl)methoxy]cyclohexyl]methanol?
The IUPAC name of [4-[(1-ethylindazol-3-yl)methoxy]cyclohexyl]methanol (CID 106825216) is [4-[(1-ethylindazol-3-yl)methoxy]cyclohexyl]methanol.
What is the SMILES notation for [4-[(1-ethylindazol-3-yl)methoxy]cyclohexyl]methanol?
The canonical SMILES for [4-[(1-ethylindazol-3-yl)methoxy]cyclohexyl]methanol is CCn1nc(COC2CCC(CO)CC2)c2ccccc21.
What is the InChIKey of [4-[(1-ethylindazol-3-yl)methoxy]cyclohexyl]methanol?
The InChIKey is WFOGPUXDKVWUGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-2-19-17-6-4-3-5-15(17)16(18-19)12-21-14-9-7-13(11-20)8-10-14/h3-6,13-14,20H,2,7-12H2,1H3.
What are the key properties of [4-[(1-ethylindazol-3-yl)methoxy]cyclohexyl]methanol?
[4-[(1-ethylindazol-3-yl)methoxy]cyclohexyl]methanol has a molecular weight of 288.39 g/mol, XLogP of 3.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(1-ethylindazol-3-yl)methoxy]cyclohexyl]methanol is sourced from PubChem (CID 106825216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).