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

C14H13N5O — CID 137045967

IUPAC2-[6-amino-5-(1-methylimidazol-4-yl)pyridazin-3-yl]phenol
SMILESCn1cnc(-c2cc(-c3ccccc3O)nnc2N)c1
InChIInChI=1S/C14H13N5O/c1-19-7-12(16-8-19)10-6-11(17-18-14(10)15)9-4-2-3-5-13(9)20/h2-8,20H,1H3,(H2,15,18)
InChIKeyDGCXLWUXCRWGHQ-UHFFFAOYSA-N
MW267.29 g/mol
LogP1.83
Rot. Bonds2

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

2-[6-amino-5-(1-methylimidazol-4-yl)pyridazin-3-yl]phenol (PubChem CID 137045967) has the molecular formula C14H13N5O and a molecular weight of 267.29 g/mol. Its IUPAC name is 2-[6-amino-5-(1-methylimidazol-4-yl)pyridazin-3-yl]phenol.

Molecular Properties

Compound Name2-[6-amino-5-(1-methylimidazol-4-yl)pyridazin-3-yl]phenol
PubChem CID137045967
Molecular FormulaC14H13N5O
Molecular Weight267.29 g/mol
Exact Mass267.11
IUPAC Name2-[6-amino-5-(1-methylimidazol-4-yl)pyridazin-3-yl]phenol
SMILESCn1cnc(-c2cc(-c3ccccc3O)nnc2N)c1
InChIInChI=1S/C14H13N5O/c1-19-7-12(16-8-19)10-6-11(17-18-14(10)15)9-4-2-3-5-13(9)20/h2-8,20H,1H3,(H2,15,18)
InChIKeyDGCXLWUXCRWGHQ-UHFFFAOYSA-N
XLogP1.83
TPSA89.85 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[6-amino-5-(1-methylimidazol-4-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

Related Compounds

Crt 0066101
CID 136189563
4-[[6-(4-Fluorophenyl)-[1,2,4]triazolo[4,3-B][1,2,4]triazin-3-Yl]methyl]phenol
CID 11324689
2-(3-Benzylimidazol-4-yl)phenol
CID 2806275
4-{2-amino-1-methyl-1H-imidazo[4,5-b]pyridin-6-yl}phenol
CID 15897928
4-{2-[(6-Methyl[1,2,4]triazolo[4,3-B]pyridazin-8-Yl)amino]ethyl}phenol
CID 86276157
2-[3-(7-Amino-2-phenylpyrazolo[4,3-d]pyrimidin-5-yl)propyl]phenol
CID 118708238
3-[3-(7-Amino-2-phenylpyrazolo[4,3-d]pyrimidin-5-yl)propyl]phenol
CID 118708239
2-Methyl-5-(pyrrolo[2,1-f][1,2,4]triazin-4-ylamino)-phenol
CID 9794758
2-Methyl-5-(5-methyl-pyrrolo[2,1-f][1,2,4]triazin-4-ylamino)-phenol
CID 9859850
2-Methyl-5-(6-methyl-pyrrolo[2,1-f][1,2,4]triazin-4-ylamino)-phenol
CID 10131256
5-(5,6-Dimethyl-pyrrolo[2,1-f][1,2,4]triazin-4-ylamino)-2-methyl-phenol
CID 10199254
4-[(6-Phenyl-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl)methyl]phenol
CID 11381132

Frequently Asked Questions

What is the IUPAC name of 2-[6-amino-5-(1-methylimidazol-4-yl)pyridazin-3-yl]phenol?
The IUPAC name of 2-[6-amino-5-(1-methylimidazol-4-yl)pyridazin-3-yl]phenol (CID 137045967) is 2-[6-amino-5-(1-methylimidazol-4-yl)pyridazin-3-yl]phenol.
What is the SMILES notation for 2-[6-amino-5-(1-methylimidazol-4-yl)pyridazin-3-yl]phenol?
The canonical SMILES for 2-[6-amino-5-(1-methylimidazol-4-yl)pyridazin-3-yl]phenol is Cn1cnc(-c2cc(-c3ccccc3O)nnc2N)c1.
What is the InChIKey of 2-[6-amino-5-(1-methylimidazol-4-yl)pyridazin-3-yl]phenol?
The InChIKey is DGCXLWUXCRWGHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O/c1-19-7-12(16-8-19)10-6-11(17-18-14(10)15)9-4-2-3-5-13(9)20/h2-8,20H,1H3,(H2,15,18).
What are the key properties of 2-[6-amino-5-(1-methylimidazol-4-yl)pyridazin-3-yl]phenol?
2-[6-amino-5-(1-methylimidazol-4-yl)pyridazin-3-yl]phenol has a molecular weight of 267.29 g/mol, XLogP of 1.83, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-amino-5-(1-methylimidazol-4-yl)pyridazin-3-yl]phenol is sourced from PubChem (CID 137045967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).