[4-(1,3,5-trimethylpyrazol-4-yl)oxy-3-pyridinyl]methanol

C12H15N3O2 — CID 81237974

IUPAC[4-(1,3,5-trimethylpyrazol-4-yl)oxy-3-pyridinyl]methanol
SMILESCc1nn(C)c(C)c1Oc1ccncc1CO
InChIInChI=1S/C12H15N3O2/c1-8-12(9(2)15(3)14-8)17-11-4-5-13-6-10(11)7-16/h4-6,16H,7H2,1-3H3
InChIKeyLJMXUYXNFNHZIU-UHFFFAOYSA-N
MW233.27 g/mol
LogP1.72
Rot. Bonds3

About [4-(1,3,5-trimethylpyrazol-4-yl)oxy-3-pyridinyl]methanol

[4-(1,3,5-trimethylpyrazol-4-yl)oxy-3-pyridinyl]methanol (PubChem CID 81237974) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is [4-(1,3,5-trimethylpyrazol-4-yl)oxy-3-pyridinyl]methanol.

Molecular Properties

Compound Name[4-(1,3,5-trimethylpyrazol-4-yl)oxy-3-pyridinyl]methanol
PubChem CID81237974
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC Name[4-(1,3,5-trimethylpyrazol-4-yl)oxy-3-pyridinyl]methanol
SMILESCc1nn(C)c(C)c1Oc1ccncc1CO
InChIInChI=1S/C12H15N3O2/c1-8-12(9(2)15(3)14-8)17-11-4-5-13-6-10(11)7-16/h4-6,16H,7H2,1-3H3
InChIKeyLJMXUYXNFNHZIU-UHFFFAOYSA-N
XLogP1.72
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [4-(1,3,5-trimethylpyrazol-4-yl)oxy-3-pyridinyl]methanol 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 [4-(1,3,5-trimethylpyrazol-4-yl)oxy-3-pyridinyl]methanol?
The IUPAC name of [4-(1,3,5-trimethylpyrazol-4-yl)oxy-3-pyridinyl]methanol (CID 81237974) is [4-(1,3,5-trimethylpyrazol-4-yl)oxy-3-pyridinyl]methanol.
What is the SMILES notation for [4-(1,3,5-trimethylpyrazol-4-yl)oxy-3-pyridinyl]methanol?
The canonical SMILES for [4-(1,3,5-trimethylpyrazol-4-yl)oxy-3-pyridinyl]methanol is Cc1nn(C)c(C)c1Oc1ccncc1CO.
What is the InChIKey of [4-(1,3,5-trimethylpyrazol-4-yl)oxy-3-pyridinyl]methanol?
The InChIKey is LJMXUYXNFNHZIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2/c1-8-12(9(2)15(3)14-8)17-11-4-5-13-6-10(11)7-16/h4-6,16H,7H2,1-3H3.
What are the key properties of [4-(1,3,5-trimethylpyrazol-4-yl)oxy-3-pyridinyl]methanol?
[4-(1,3,5-trimethylpyrazol-4-yl)oxy-3-pyridinyl]methanol has a molecular weight of 233.27 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1,3,5-trimethylpyrazol-4-yl)oxy-3-pyridinyl]methanol is sourced from PubChem (CID 81237974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).