1-ethyl-3-methylpyrazol-4-ol

C6H10N2O — CID 67980645

IUPAC1-ethyl-3-methylpyrazol-4-ol
SMILESCCn1cc(O)c(C)n1
InChIInChI=1S/C6H10N2O/c1-3-8-4-6(9)5(2)7-8/h4,9H,3H2,1-2H3
InChIKeyTYQFCFLXCXOSCB-UHFFFAOYSA-N
MW126.16 g/mol
LogP0.92
Rot. Bonds1

About 1-ethyl-3-methylpyrazol-4-ol

1-ethyl-3-methylpyrazol-4-ol (PubChem CID 67980645) has the molecular formula C6H10N2O and a molecular weight of 126.16 g/mol. Its IUPAC name is 1-ethyl-3-methylpyrazol-4-ol.

Molecular Properties

Compound Name1-ethyl-3-methylpyrazol-4-ol
PubChem CID67980645
Molecular FormulaC6H10N2O
Molecular Weight126.16 g/mol
Exact Mass126.08
IUPAC Name1-ethyl-3-methylpyrazol-4-ol
SMILESCCn1cc(O)c(C)n1
InChIInChI=1S/C6H10N2O/c1-3-8-4-6(9)5(2)7-8/h4,9H,3H2,1-2H3
InChIKeyTYQFCFLXCXOSCB-UHFFFAOYSA-N
XLogP0.92
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-ethyl-3-methylpyrazol-4-ol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-methylpyrazol-4-ol?
The IUPAC name of 1-ethyl-3-methylpyrazol-4-ol (CID 67980645) is 1-ethyl-3-methylpyrazol-4-ol.
What is the SMILES notation for 1-ethyl-3-methylpyrazol-4-ol?
The canonical SMILES for 1-ethyl-3-methylpyrazol-4-ol is CCn1cc(O)c(C)n1.
What is the InChIKey of 1-ethyl-3-methylpyrazol-4-ol?
The InChIKey is TYQFCFLXCXOSCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O/c1-3-8-4-6(9)5(2)7-8/h4,9H,3H2,1-2H3.
What are the key properties of 1-ethyl-3-methylpyrazol-4-ol?
1-ethyl-3-methylpyrazol-4-ol has a molecular weight of 126.16 g/mol, XLogP of 0.92, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-methylpyrazol-4-ol is sourced from PubChem (CID 67980645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).