1-(6-chloropyridazin-4-yl)indazol-6-amine

C11H8ClN5 — CID 175755942

IUPAC1-(6-chloropyridazin-4-yl)indazol-6-amine
SMILESNc1ccc2cnn(-c3cnnc(Cl)c3)c2c1
InChIInChI=1S/C11H8ClN5/c12-11-4-9(6-14-16-11)17-10-3-8(13)2-1-7(10)5-15-17/h1-6H,13H2
InChIKeyQXYBSJIMLOASLC-UHFFFAOYSA-N
MW245.67 g/mol
LogP2.05
Rot. Bonds1

About 1-(6-chloropyridazin-4-yl)indazol-6-amine

1-(6-chloropyridazin-4-yl)indazol-6-amine (PubChem CID 175755942) has the molecular formula C11H8ClN5 and a molecular weight of 245.67 g/mol. Its IUPAC name is 1-(6-chloropyridazin-4-yl)indazol-6-amine.

Molecular Properties

Compound Name1-(6-chloropyridazin-4-yl)indazol-6-amine
PubChem CID175755942
Molecular FormulaC11H8ClN5
Molecular Weight245.67 g/mol
Exact Mass245.05
IUPAC Name1-(6-chloropyridazin-4-yl)indazol-6-amine
SMILESNc1ccc2cnn(-c3cnnc(Cl)c3)c2c1
InChIInChI=1S/C11H8ClN5/c12-11-4-9(6-14-16-11)17-10-3-8(13)2-1-7(10)5-15-17/h1-6H,13H2
InChIKeyQXYBSJIMLOASLC-UHFFFAOYSA-N
XLogP2.05
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.67
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

6-bromo-1-(6-chloropyridazin-4-yl)indazole
CID 169236482
1-(4,6-dimethylpyrimidin-2-yl)indazol-6-amine
CID 61174887
2-(6-aminoindazol-1-yl)-5-chlorobenzonitrile
CID 62494224
1-pyridin-2-ylindazol-6-amine
CID 61176394
1-(3-ethyltriazol-4-yl)indazol-6-amine
CID 114223179
1-(5-methyl-2-pyridinyl)indazol-6-amine
CID 61175078
3-(6-aminoindazol-1-yl)pyrazine-2-carboxamide
CID 62685333
1-(2-methylpyrimidin-4-yl)indazol-6-amine
CID 55113053
1-phenylindazol-5-amine
CID 83414114
1-(cyclopropylmethyl)indazol-6-amine
CID 43646564
1-(4-fluorophenyl)indazol-5-amine
CID 59235727
2-(6-aminoindazol-1-yl)-4,6-dimethylpyridine-3-carboxamide
CID 61176213

Frequently Asked Questions

What is the IUPAC name of 1-(6-chloropyridazin-4-yl)indazol-6-amine?
The IUPAC name of 1-(6-chloropyridazin-4-yl)indazol-6-amine (CID 175755942) is 1-(6-chloropyridazin-4-yl)indazol-6-amine.
What is the SMILES notation for 1-(6-chloropyridazin-4-yl)indazol-6-amine?
The canonical SMILES for 1-(6-chloropyridazin-4-yl)indazol-6-amine is Nc1ccc2cnn(-c3cnnc(Cl)c3)c2c1.
What is the InChIKey of 1-(6-chloropyridazin-4-yl)indazol-6-amine?
The InChIKey is QXYBSJIMLOASLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClN5/c12-11-4-9(6-14-16-11)17-10-3-8(13)2-1-7(10)5-15-17/h1-6H,13H2.
What are the key properties of 1-(6-chloropyridazin-4-yl)indazol-6-amine?
1-(6-chloropyridazin-4-yl)indazol-6-amine has a molecular weight of 245.67 g/mol, XLogP of 2.05, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-chloropyridazin-4-yl)indazol-6-amine is sourced from PubChem (CID 175755942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).