2-(4-methyl-1-phenylpyrazol-3-yl)ethanol

C12H14N2O — CID 142747347

IUPAC2-(4-methyl-1-phenylpyrazol-3-yl)ethanol
SMILESCc1cn(-c2ccccc2)nc1CCO
InChIInChI=1S/C12H14N2O/c1-10-9-14(13-12(10)7-8-15)11-5-3-2-4-6-11/h2-6,9,15H,7-8H2,1H3
InChIKeyRPWIUBIFYVEIHM-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.72
Rot. Bonds3

About 2-(4-methyl-1-phenylpyrazol-3-yl)ethanol

2-(4-methyl-1-phenylpyrazol-3-yl)ethanol (PubChem CID 142747347) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 2-(4-methyl-1-phenylpyrazol-3-yl)ethanol.

Molecular Properties

Compound Name2-(4-methyl-1-phenylpyrazol-3-yl)ethanol
PubChem CID142747347
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name2-(4-methyl-1-phenylpyrazol-3-yl)ethanol
SMILESCc1cn(-c2ccccc2)nc1CCO
InChIInChI=1S/C12H14N2O/c1-10-9-14(13-12(10)7-8-15)11-5-3-2-4-6-11/h2-6,9,15H,7-8H2,1H3
InChIKeyRPWIUBIFYVEIHM-UHFFFAOYSA-N
XLogP1.72
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(4-methyl-1-phenylpyrazol-3-yl)methyl]phenol
CID 23402776
2-[4-(4-methyl-1-phenylpyrazol-3-yl)pyrazol-1-yl]ethanol
CID 142747346
4-methyl-1-phenylpyrazol-3-amine
CID 12847947
2-(1-phenyltriazol-4-yl)ethanol
CID 62400146
2-[4-bromo-1-(4-methoxyphenyl)pyrazol-3-yl]ethanol
CID 116818802
1-(1-hydroxybutan-2-yl)-3-(4-methyl-1-phenylpyrazol-3-yl)urea
CID 111107558
1-(1-hydroxy-4-methylpentan-3-yl)-3-(4-methyl-1-phenylpyrazol-3-yl)urea
CID 71992278
4,7-dimethyl-2-phenylindazole
CID 175730275
2-(1,4-diphenylpyrazol-3-yl)acetamide
CID 21418445
5-(2-hydroxyethyl)-3-methyl-1-phenylpyrazole-4-carboxylic acid
CID 12826132
1-(4-chloro-1-phenylpyrazol-3-yl)-N-methylmethanamine
CID 83890375
4-methoxy-3-(methoxymethyl)-1-phenylpyrazole
CID 174644530

Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-1-phenylpyrazol-3-yl)ethanol?
The IUPAC name of 2-(4-methyl-1-phenylpyrazol-3-yl)ethanol (CID 142747347) is 2-(4-methyl-1-phenylpyrazol-3-yl)ethanol.
What is the SMILES notation for 2-(4-methyl-1-phenylpyrazol-3-yl)ethanol?
The canonical SMILES for 2-(4-methyl-1-phenylpyrazol-3-yl)ethanol is Cc1cn(-c2ccccc2)nc1CCO.
What is the InChIKey of 2-(4-methyl-1-phenylpyrazol-3-yl)ethanol?
The InChIKey is RPWIUBIFYVEIHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-10-9-14(13-12(10)7-8-15)11-5-3-2-4-6-11/h2-6,9,15H,7-8H2,1H3.
What are the key properties of 2-(4-methyl-1-phenylpyrazol-3-yl)ethanol?
2-(4-methyl-1-phenylpyrazol-3-yl)ethanol has a molecular weight of 202.26 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-1-phenylpyrazol-3-yl)ethanol is sourced from PubChem (CID 142747347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).