2-(1-ethylbenzimidazol-2-yl)-1-(1-methylpyrazol-4-yl)ethanol

C15H18N4O — CID 79753821

IUPAC2-(1-ethylbenzimidazol-2-yl)-1-(1-methylpyrazol-4-yl)ethanol
SMILESCCn1c(CC(O)c2cnn(C)c2)nc2ccccc21
InChIInChI=1S/C15H18N4O/c1-3-19-13-7-5-4-6-12(13)17-15(19)8-14(20)11-9-16-18(2)10-11/h4-7,9-10,14,20H,3,8H2,1-2H3
InChIKeyDQSNEXLYPPGKTC-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.07
Rot. Bonds4

About 2-(1-ethylbenzimidazol-2-yl)-1-(1-methylpyrazol-4-yl)ethanol

2-(1-ethylbenzimidazol-2-yl)-1-(1-methylpyrazol-4-yl)ethanol (PubChem CID 79753821) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 2-(1-ethylbenzimidazol-2-yl)-1-(1-methylpyrazol-4-yl)ethanol.

Molecular Properties

Compound Name2-(1-ethylbenzimidazol-2-yl)-1-(1-methylpyrazol-4-yl)ethanol
PubChem CID79753821
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name2-(1-ethylbenzimidazol-2-yl)-1-(1-methylpyrazol-4-yl)ethanol
SMILESCCn1c(CC(O)c2cnn(C)c2)nc2ccccc21
InChIInChI=1S/C15H18N4O/c1-3-19-13-7-5-4-6-12(13)17-15(19)8-14(20)11-9-16-18(2)10-11/h4-7,9-10,14,20H,3,8H2,1-2H3
InChIKeyDQSNEXLYPPGKTC-UHFFFAOYSA-N
XLogP2.07
TPSA55.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1-ethylbenzimidazol-2-yl)-1-(4-fluorophenyl)ethanol
CID 79754584
2-(1-ethylbenzimidazol-2-yl)-1-(4-iodophenyl)ethanol
CID 115818620
2-(1-ethylbenzimidazol-2-yl)-1-(5-methyl-3-pyridinyl)ethanol
CID 105111618
1-(1-ethylbenzimidazol-2-yl)propan-2-ol
CID 79753828
2-(1-ethylbenzimidazol-2-yl)-1-(3-iodophenyl)ethanol
CID 115818522
2-(1-ethylbenzimidazol-2-yl)-1-(5-methylfuran-3-yl)ethanol
CID 115818572
2-(1-ethylbenzimidazol-2-yl)-1-(2-methyl-4-pyridinyl)ethanol
CID 106756272
2-(1-ethylbenzimidazol-2-yl)-1-(1-methylpyrazol-4-yl)ethanone
CID 79753537
2-(1-ethylbenzimidazol-2-yl)-1-(1-methylcyclohexyl)ethanol
CID 106830947
1-(5-chloro-1,3-thiazol-2-yl)-2-(1-ethylbenzimidazol-2-yl)ethanol
CID 107125122
2-(1-ethylbenzimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)ethanol
CID 115527844
1,1-diethoxy-3-(1-ethylbenzimidazol-2-yl)propan-2-ol
CID 79756098

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylbenzimidazol-2-yl)-1-(1-methylpyrazol-4-yl)ethanol?
The IUPAC name of 2-(1-ethylbenzimidazol-2-yl)-1-(1-methylpyrazol-4-yl)ethanol (CID 79753821) is 2-(1-ethylbenzimidazol-2-yl)-1-(1-methylpyrazol-4-yl)ethanol.
What is the SMILES notation for 2-(1-ethylbenzimidazol-2-yl)-1-(1-methylpyrazol-4-yl)ethanol?
The canonical SMILES for 2-(1-ethylbenzimidazol-2-yl)-1-(1-methylpyrazol-4-yl)ethanol is CCn1c(CC(O)c2cnn(C)c2)nc2ccccc21.
What is the InChIKey of 2-(1-ethylbenzimidazol-2-yl)-1-(1-methylpyrazol-4-yl)ethanol?
The InChIKey is DQSNEXLYPPGKTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-3-19-13-7-5-4-6-12(13)17-15(19)8-14(20)11-9-16-18(2)10-11/h4-7,9-10,14,20H,3,8H2,1-2H3.
What are the key properties of 2-(1-ethylbenzimidazol-2-yl)-1-(1-methylpyrazol-4-yl)ethanol?
2-(1-ethylbenzimidazol-2-yl)-1-(1-methylpyrazol-4-yl)ethanol has a molecular weight of 270.34 g/mol, XLogP of 2.07, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylbenzimidazol-2-yl)-1-(1-methylpyrazol-4-yl)ethanol is sourced from PubChem (CID 79753821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).