(1,5-dimethylpyrazol-4-yl)-[methyl(pyridazin-4-yl)amino]methanol

C11H15N5O — CID 123583673

IUPAC(1,5-dimethylpyrazol-4-yl)-[methyl(pyridazin-4-yl)amino]methanol
SMILESCc1c(C(O)N(C)c2ccnnc2)cnn1C
InChIInChI=1S/C11H15N5O/c1-8-10(7-14-16(8)3)11(17)15(2)9-4-5-12-13-6-9/h4-7,11,17H,1-3H3
InChIKeyQHNBUFFPHRTGSJ-UHFFFAOYSA-N
MW233.28 g/mol
LogP0.65
Rot. Bonds3

About (1,5-dimethylpyrazol-4-yl)-[methyl(pyridazin-4-yl)amino]methanol

(1,5-dimethylpyrazol-4-yl)-[methyl(pyridazin-4-yl)amino]methanol (PubChem CID 123583673) has the molecular formula C11H15N5O and a molecular weight of 233.28 g/mol. Its IUPAC name is (1,5-dimethylpyrazol-4-yl)-[methyl(pyridazin-4-yl)amino]methanol.

Molecular Properties

Compound Name(1,5-dimethylpyrazol-4-yl)-[methyl(pyridazin-4-yl)amino]methanol
PubChem CID123583673
Molecular FormulaC11H15N5O
Molecular Weight233.28 g/mol
Exact Mass233.13
IUPAC Name(1,5-dimethylpyrazol-4-yl)-[methyl(pyridazin-4-yl)amino]methanol
SMILESCc1c(C(O)N(C)c2ccnnc2)cnn1C
InChIInChI=1S/C11H15N5O/c1-8-10(7-14-16(8)3)11(17)15(2)9-4-5-12-13-6-9/h4-7,11,17H,1-3H3
InChIKeyQHNBUFFPHRTGSJ-UHFFFAOYSA-N
XLogP0.65
TPSA67.07 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.28
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze (1,5-dimethylpyrazol-4-yl)-[methyl(pyridazin-4-yl)amino]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 (1,5-dimethylpyrazol-4-yl)-[methyl(pyridazin-4-yl)amino]methanol?
The IUPAC name of (1,5-dimethylpyrazol-4-yl)-[methyl(pyridazin-4-yl)amino]methanol (CID 123583673) is (1,5-dimethylpyrazol-4-yl)-[methyl(pyridazin-4-yl)amino]methanol.
What is the SMILES notation for (1,5-dimethylpyrazol-4-yl)-[methyl(pyridazin-4-yl)amino]methanol?
The canonical SMILES for (1,5-dimethylpyrazol-4-yl)-[methyl(pyridazin-4-yl)amino]methanol is Cc1c(C(O)N(C)c2ccnnc2)cnn1C.
What is the InChIKey of (1,5-dimethylpyrazol-4-yl)-[methyl(pyridazin-4-yl)amino]methanol?
The InChIKey is QHNBUFFPHRTGSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-8-10(7-14-16(8)3)11(17)15(2)9-4-5-12-13-6-9/h4-7,11,17H,1-3H3.
What are the key properties of (1,5-dimethylpyrazol-4-yl)-[methyl(pyridazin-4-yl)amino]methanol?
(1,5-dimethylpyrazol-4-yl)-[methyl(pyridazin-4-yl)amino]methanol has a molecular weight of 233.28 g/mol, XLogP of 0.65, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1,5-dimethylpyrazol-4-yl)-[methyl(pyridazin-4-yl)amino]methanol is sourced from PubChem (CID 123583673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).