1-(3-bromofuran-2-yl)-2-(1-cyclohexylpyrazol-3-yl)ethanol

C15H19BrN2O2 — CID 106886364

IUPAC1-(3-bromofuran-2-yl)-2-(1-cyclohexylpyrazol-3-yl)ethanol
SMILESOC(Cc1ccn(C2CCCCC2)n1)c1occc1Br
InChIInChI=1S/C15H19BrN2O2/c16-13-7-9-20-15(13)14(19)10-11-6-8-18(17-11)12-4-2-1-3-5-12/h6-9,12,14,19H,1-5,10H2
InChIKeyHJKIDRCBTAXKPJ-UHFFFAOYSA-N
MW339.23 g/mol
LogP4.02
Rot. Bonds4

About 1-(3-bromofuran-2-yl)-2-(1-cyclohexylpyrazol-3-yl)ethanol

1-(3-bromofuran-2-yl)-2-(1-cyclohexylpyrazol-3-yl)ethanol (PubChem CID 106886364) has the molecular formula C15H19BrN2O2 and a molecular weight of 339.23 g/mol. Its IUPAC name is 1-(3-bromofuran-2-yl)-2-(1-cyclohexylpyrazol-3-yl)ethanol.

Molecular Properties

Compound Name1-(3-bromofuran-2-yl)-2-(1-cyclohexylpyrazol-3-yl)ethanol
PubChem CID106886364
Molecular FormulaC15H19BrN2O2
Molecular Weight339.23 g/mol
Exact Mass338.06
IUPAC Name1-(3-bromofuran-2-yl)-2-(1-cyclohexylpyrazol-3-yl)ethanol
SMILESOC(Cc1ccn(C2CCCCC2)n1)c1occc1Br
InChIInChI=1S/C15H19BrN2O2/c16-13-7-9-20-15(13)14(19)10-11-6-8-18(17-11)12-4-2-1-3-5-12/h6-9,12,14,19H,1-5,10H2
InChIKeyHJKIDRCBTAXKPJ-UHFFFAOYSA-N
XLogP4.02
TPSA51.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.23
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(3-bromofuran-2-yl)-2-(1-cyclohexylpyrazol-3-yl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-bromofuran-3-yl)-2-(1-cyclopentylpyrazol-3-yl)ethanol
CID 106859308
1-(2-bromophenyl)-2-(1-cyclohexylpyrazol-3-yl)ethanol
CID 64786012
1-(4-bromophenyl)-2-(1-cyclohexylpyrazol-3-yl)ethanol
CID 64784262
1-(4-bromophenyl)-2-(1-cyclopentylpyrazol-3-yl)ethanol
CID 64784263
1-(2-bromo-5-methylphenyl)-2-(1-cyclopentylpyrazol-3-yl)ethanol
CID 115810015
1-(1-cyclohexylpyrazol-3-yl)-3-methoxybutan-2-ol
CID 79616778
2-(1-cyclohexylpyrazol-3-yl)-1-(2-iodophenyl)ethanol
CID 115805134
1-(2-bromophenyl)-3-(1-cyclopentylpyrazol-3-yl)propan-2-ol
CID 64785473
2-(1-cyclohexylpyrazol-3-yl)-1-(5-methyl-3-pyridinyl)ethanol
CID 105102376
1-(3-bromo-5-fluorophenyl)-2-(1-cyclopentylpyrazol-3-yl)ethanol
CID 66425230
1-(1-cyclopentylpyrazol-3-yl)-4-methylpentane-2,3-diol
CID 103456685
1-(4-bromophenyl)-3-(1-cyclopentylpyrazol-3-yl)propan-2-ol
CID 64785466

Frequently Asked Questions

What is the IUPAC name of 1-(3-bromofuran-2-yl)-2-(1-cyclohexylpyrazol-3-yl)ethanol?
The IUPAC name of 1-(3-bromofuran-2-yl)-2-(1-cyclohexylpyrazol-3-yl)ethanol (CID 106886364) is 1-(3-bromofuran-2-yl)-2-(1-cyclohexylpyrazol-3-yl)ethanol.
What is the SMILES notation for 1-(3-bromofuran-2-yl)-2-(1-cyclohexylpyrazol-3-yl)ethanol?
The canonical SMILES for 1-(3-bromofuran-2-yl)-2-(1-cyclohexylpyrazol-3-yl)ethanol is OC(Cc1ccn(C2CCCCC2)n1)c1occc1Br.
What is the InChIKey of 1-(3-bromofuran-2-yl)-2-(1-cyclohexylpyrazol-3-yl)ethanol?
The InChIKey is HJKIDRCBTAXKPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19BrN2O2/c16-13-7-9-20-15(13)14(19)10-11-6-8-18(17-11)12-4-2-1-3-5-12/h6-9,12,14,19H,1-5,10H2.
What are the key properties of 1-(3-bromofuran-2-yl)-2-(1-cyclohexylpyrazol-3-yl)ethanol?
1-(3-bromofuran-2-yl)-2-(1-cyclohexylpyrazol-3-yl)ethanol has a molecular weight of 339.23 g/mol, XLogP of 4.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-bromofuran-2-yl)-2-(1-cyclohexylpyrazol-3-yl)ethanol is sourced from PubChem (CID 106886364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).