5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol

C11H13N3O — CID 90747187

IUPAC5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol
SMILESCCc1c(O)c(C)nn1-c1ccccn1
InChIInChI=1S/C11H13N3O/c1-3-9-11(15)8(2)13-14(9)10-6-4-5-7-12-10/h4-7,15H,3H2,1-2H3
InChIKeyBMJGPXAKDDIVJX-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.84
Rot. Bonds2

About 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol

5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol (PubChem CID 90747187) has the molecular formula C11H13N3O and a molecular weight of 203.25 g/mol. Its IUPAC name is 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol.

Molecular Properties

Compound Name5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol
PubChem CID90747187
Molecular FormulaC11H13N3O
Molecular Weight203.25 g/mol
Exact Mass203.11
IUPAC Name5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol
SMILESCCc1c(O)c(C)nn1-c1ccccn1
InChIInChI=1S/C11H13N3O/c1-3-9-11(15)8(2)13-14(9)10-6-4-5-7-12-10/h4-7,15H,3H2,1-2H3
InChIKeyBMJGPXAKDDIVJX-UHFFFAOYSA-N
XLogP1.84
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol?
The IUPAC name of 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol (CID 90747187) is 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol.
What is the SMILES notation for 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol?
The canonical SMILES for 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol is CCc1c(O)c(C)nn1-c1ccccn1.
What is the InChIKey of 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol?
The InChIKey is BMJGPXAKDDIVJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-3-9-11(15)8(2)13-14(9)10-6-4-5-7-12-10/h4-7,15H,3H2,1-2H3.
What are the key properties of 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol?
5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol has a molecular weight of 203.25 g/mol, XLogP of 1.84, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol is sourced from PubChem (CID 90747187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).