1-(3-ethylimidazol-4-yl)-2-(1-ethylpyrazol-4-yl)ethanol

C12H18N4O — CID 66134538

IUPAC1-(3-ethylimidazol-4-yl)-2-(1-ethylpyrazol-4-yl)ethanol
SMILESCCn1cc(CC(O)c2cncn2CC)cn1
InChIInChI=1S/C12H18N4O/c1-3-15-9-13-7-11(15)12(17)5-10-6-14-16(4-2)8-10/h6-9,12,17H,3-5H2,1-2H3
InChIKeyGUDZDAIRPZIPFH-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.40
Rot. Bonds5

About 1-(3-ethylimidazol-4-yl)-2-(1-ethylpyrazol-4-yl)ethanol

1-(3-ethylimidazol-4-yl)-2-(1-ethylpyrazol-4-yl)ethanol (PubChem CID 66134538) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 1-(3-ethylimidazol-4-yl)-2-(1-ethylpyrazol-4-yl)ethanol.

Molecular Properties

Compound Name1-(3-ethylimidazol-4-yl)-2-(1-ethylpyrazol-4-yl)ethanol
PubChem CID66134538
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name1-(3-ethylimidazol-4-yl)-2-(1-ethylpyrazol-4-yl)ethanol
SMILESCCn1cc(CC(O)c2cncn2CC)cn1
InChIInChI=1S/C12H18N4O/c1-3-15-9-13-7-11(15)12(17)5-10-6-14-16(4-2)8-10/h6-9,12,17H,3-5H2,1-2H3
InChIKeyGUDZDAIRPZIPFH-UHFFFAOYSA-N
XLogP1.40
TPSA55.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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2-(4-bromophenyl)-1-(3-ethylimidazol-4-yl)ethanol
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1-(3-ethylimidazol-4-yl)-2-methoxyethanol
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2-(4-chloro-3-fluorophenyl)-1-(3-ethylimidazol-4-yl)ethanol
CID 114012562
1-(1-ethylpyrazol-4-yl)-3,3-dimethylpentan-2-ol
CID 115780671
4-ethyl-1-(1-ethylpyrazol-4-yl)hexane-2,3-diol
CID 103459765
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2-amino-3-(1-ethylpyrazol-4-yl)propan-1-ol
CID 64571799

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethylimidazol-4-yl)-2-(1-ethylpyrazol-4-yl)ethanol?
The IUPAC name of 1-(3-ethylimidazol-4-yl)-2-(1-ethylpyrazol-4-yl)ethanol (CID 66134538) is 1-(3-ethylimidazol-4-yl)-2-(1-ethylpyrazol-4-yl)ethanol.
What is the SMILES notation for 1-(3-ethylimidazol-4-yl)-2-(1-ethylpyrazol-4-yl)ethanol?
The canonical SMILES for 1-(3-ethylimidazol-4-yl)-2-(1-ethylpyrazol-4-yl)ethanol is CCn1cc(CC(O)c2cncn2CC)cn1.
What is the InChIKey of 1-(3-ethylimidazol-4-yl)-2-(1-ethylpyrazol-4-yl)ethanol?
The InChIKey is GUDZDAIRPZIPFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c1-3-15-9-13-7-11(15)12(17)5-10-6-14-16(4-2)8-10/h6-9,12,17H,3-5H2,1-2H3.
What are the key properties of 1-(3-ethylimidazol-4-yl)-2-(1-ethylpyrazol-4-yl)ethanol?
1-(3-ethylimidazol-4-yl)-2-(1-ethylpyrazol-4-yl)ethanol has a molecular weight of 234.30 g/mol, XLogP of 1.40, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethylimidazol-4-yl)-2-(1-ethylpyrazol-4-yl)ethanol is sourced from PubChem (CID 66134538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).