6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)naphthalen-1-ol

C19H15N3O — CID 11601866

IUPAC6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)naphthalen-1-ol
SMILESCn1cc(-c2ccc3c(O)cccc3c2)c(-c2ccncc2)n1
InChIInChI=1S/C19H15N3O/c1-22-12-17(19(21-22)13-7-9-20-10-8-13)15-5-6-16-14(11-15)3-2-4-18(16)23/h2-12,23H,1H3
InChIKeyHXGBUKKPDSRQTR-UHFFFAOYSA-N
MW301.35 g/mol
LogP4.01
Rot. Bonds2

About 6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)naphthalen-1-ol

6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)naphthalen-1-ol (PubChem CID 11601866) has the molecular formula C19H15N3O and a molecular weight of 301.35 g/mol. Its IUPAC name is 6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)naphthalen-1-ol.

Molecular Properties

Compound Name6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)naphthalen-1-ol
PubChem CID11601866
Molecular FormulaC19H15N3O
Molecular Weight301.35 g/mol
Exact Mass301.12
IUPAC Name6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)naphthalen-1-ol
SMILESCn1cc(-c2ccc3c(O)cccc3c2)c(-c2ccncc2)n1
InChIInChI=1S/C19H15N3O/c1-22-12-17(19(21-22)13-7-9-20-10-8-13)15-5-6-16-14(11-15)3-2-4-18(16)23/h2-12,23H,1H3
InChIKeyHXGBUKKPDSRQTR-UHFFFAOYSA-N
XLogP4.01
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)naphthalen-1-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 6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)naphthalen-1-ol?
The IUPAC name of 6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)naphthalen-1-ol (CID 11601866) is 6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)naphthalen-1-ol.
What is the SMILES notation for 6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)naphthalen-1-ol?
The canonical SMILES for 6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)naphthalen-1-ol is Cn1cc(-c2ccc3c(O)cccc3c2)c(-c2ccncc2)n1.
What is the InChIKey of 6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)naphthalen-1-ol?
The InChIKey is HXGBUKKPDSRQTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3O/c1-22-12-17(19(21-22)13-7-9-20-10-8-13)15-5-6-16-14(11-15)3-2-4-18(16)23/h2-12,23H,1H3.
What are the key properties of 6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)naphthalen-1-ol?
6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)naphthalen-1-ol has a molecular weight of 301.35 g/mol, XLogP of 4.01, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)naphthalen-1-ol is sourced from PubChem (CID 11601866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).