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

C6H10N2O — CID 17028076

IUPAC2-(1-methylpyrazol-4-yl)ethanol
SMILESCn1cc(CCO)cn1
InChIInChI=1S/C6H10N2O/c1-8-5-6(2-3-9)4-7-8/h4-5,9H,2-3H2,1H3
InChIKeyZQEOCSYOGWFPTB-UHFFFAOYSA-N
MW126.16 g/mol
LogP-0.05
Rot. Bonds2

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

2-(1-methylpyrazol-4-yl)ethanol (PubChem CID 17028076) has the molecular formula C6H10N2O and a molecular weight of 126.16 g/mol. Its IUPAC name is 2-(1-methylpyrazol-4-yl)ethanol.

Molecular Properties

Compound Name2-(1-methylpyrazol-4-yl)ethanol
PubChem CID17028076
Molecular FormulaC6H10N2O
Molecular Weight126.16 g/mol
Exact Mass126.08
IUPAC Name2-(1-methylpyrazol-4-yl)ethanol
SMILESCn1cc(CCO)cn1
InChIInChI=1S/C6H10N2O/c1-8-5-6(2-3-9)4-7-8/h4-5,9H,2-3H2,1H3
InChIKeyZQEOCSYOGWFPTB-UHFFFAOYSA-N
XLogP-0.05
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[2-(1-methylpyrazol-4-yl)ethoxy]phenyl]ethanol
CID 103844540
dideuterio-(1-methylpyrazol-4-yl)methanol
CID 170523002
1-methyl-4-propylpyrazole;propane
CID 155742221
4-(2-bromoethyl)-1-methylpyrazole
CID 54593836
3-(1-methylpyrazol-4-yl)propan-1-amine
CID 47003365
2-(hydroxymethyl)-2-[2-(1-methylpyrazol-4-yl)ethylamino]propane-1,3-diol
CID 107852417
2-[1-(1-methylpyrrolidin-3-yl)pyrazol-4-yl]ethanol
CID 105449213
2-[2-(1-methylpyrazol-4-yl)ethylamino]propan-1-ol
CID 103000884
2-[(1-methylpyrazol-4-yl)methyl]propane-1,3-diol
CID 79450253
4-(2-isocyanoethyl)-1-methylpyrazole
CID 83478886
2-methyl-5-(1-methylpyrazol-4-yl)pentan-2-ol
CID 164967779
4-hydroxy-N-[2-(1-methylpyrazol-4-yl)ethyl]butanamide
CID 80686901

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpyrazol-4-yl)ethanol?
The IUPAC name of 2-(1-methylpyrazol-4-yl)ethanol (CID 17028076) is 2-(1-methylpyrazol-4-yl)ethanol.
What is the SMILES notation for 2-(1-methylpyrazol-4-yl)ethanol?
The canonical SMILES for 2-(1-methylpyrazol-4-yl)ethanol is Cn1cc(CCO)cn1.
What is the InChIKey of 2-(1-methylpyrazol-4-yl)ethanol?
The InChIKey is ZQEOCSYOGWFPTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O/c1-8-5-6(2-3-9)4-7-8/h4-5,9H,2-3H2,1H3.
What are the key properties of 2-(1-methylpyrazol-4-yl)ethanol?
2-(1-methylpyrazol-4-yl)ethanol has a molecular weight of 126.16 g/mol, XLogP of -0.05, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpyrazol-4-yl)ethanol is sourced from PubChem (CID 17028076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).