2-[6-amino-5-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenol

C16H20N4O — CID 152825660

IUPAC2-[6-amino-5-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenol
SMILESCC1CCN(c2cc(-c3ccccc3O)nnc2N)CC1
InChIInChI=1S/C16H20N4O/c1-11-6-8-20(9-7-11)14-10-13(18-19-16(14)17)12-4-2-3-5-15(12)21/h2-5,10-11,21H,6-9H2,1H3,(H2,17,19)
InChIKeySVARSPLFJFANJU-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.67
Rot. Bonds2

About 2-[6-amino-5-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenol

2-[6-amino-5-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenol (PubChem CID 152825660) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-[6-amino-5-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenol.

Molecular Properties

Compound Name2-[6-amino-5-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenol
PubChem CID152825660
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name2-[6-amino-5-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenol
SMILESCC1CCN(c2cc(-c3ccccc3O)nnc2N)CC1
InChIInChI=1S/C16H20N4O/c1-11-6-8-20(9-7-11)14-10-13(18-19-16(14)17)12-4-2-3-5-15(12)21/h2-5,10-11,21H,6-9H2,1H3,(H2,17,19)
InChIKeySVARSPLFJFANJU-UHFFFAOYSA-N
XLogP2.67
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[6-amino-5-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenol 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 2-[6-amino-5-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenol?
The IUPAC name of 2-[6-amino-5-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenol (CID 152825660) is 2-[6-amino-5-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenol.
What is the SMILES notation for 2-[6-amino-5-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenol?
The canonical SMILES for 2-[6-amino-5-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenol is CC1CCN(c2cc(-c3ccccc3O)nnc2N)CC1.
What is the InChIKey of 2-[6-amino-5-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenol?
The InChIKey is SVARSPLFJFANJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-11-6-8-20(9-7-11)14-10-13(18-19-16(14)17)12-4-2-3-5-15(12)21/h2-5,10-11,21H,6-9H2,1H3,(H2,17,19).
What are the key properties of 2-[6-amino-5-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenol?
2-[6-amino-5-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenol has a molecular weight of 284.36 g/mol, XLogP of 2.67, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-amino-5-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenol is sourced from PubChem (CID 152825660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).