6-chloro-N-(2-phenoxyphenyl)pyridazin-3-amine

C16H12ClN3O — CID 43329642

IUPAC6-chloro-N-(2-phenoxyphenyl)pyridazin-3-amine
SMILESClc1ccc(Nc2ccccc2Oc2ccccc2)nn1
InChIInChI=1S/C16H12ClN3O/c17-15-10-11-16(20-19-15)18-13-8-4-5-9-14(13)21-12-6-2-1-3-7-12/h1-11H,(H,18,20)
InChIKeyZQXHSPUQVMITFK-UHFFFAOYSA-N
MW297.75 g/mol
LogP4.67
Rot. Bonds4

About 6-chloro-N-(2-phenoxyphenyl)pyridazin-3-amine

6-chloro-N-(2-phenoxyphenyl)pyridazin-3-amine (PubChem CID 43329642) has the molecular formula C16H12ClN3O and a molecular weight of 297.75 g/mol. Its IUPAC name is 6-chloro-N-(2-phenoxyphenyl)pyridazin-3-amine.

Molecular Properties

Compound Name6-chloro-N-(2-phenoxyphenyl)pyridazin-3-amine
PubChem CID43329642
Molecular FormulaC16H12ClN3O
Molecular Weight297.75 g/mol
Exact Mass297.07
IUPAC Name6-chloro-N-(2-phenoxyphenyl)pyridazin-3-amine
SMILESClc1ccc(Nc2ccccc2Oc2ccccc2)nn1
InChIInChI=1S/C16H12ClN3O/c17-15-10-11-16(20-19-15)18-13-8-4-5-9-14(13)21-12-6-2-1-3-7-12/h1-11H,(H,18,20)
InChIKeyZQXHSPUQVMITFK-UHFFFAOYSA-N
XLogP4.67
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.75
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N-(2-phenoxyphenyl)pyrazin-2-amine
CID 63548200
6-chloro-N-(2-phenylphenyl)pyridazin-3-amine
CID 43329636
N-[6-(2-phenoxyanilino)pyridazin-3-yl]oxane-4-carboxamide
CID 113050613
6-bromo-N-(2-phenoxyphenyl)pyridin-2-amine
CID 63963847
N-(2-methylpropyl)-6-(2-phenoxyanilino)pyridazine-3-carboxamide
CID 109111323
N-cyclopentyl-6-(2-phenoxyanilino)pyridazine-3-carboxamide
CID 109112427
N-methyl-2-phenoxyaniline
CID 22961955
N-[2-(dimethylamino)ethyl]-6-(2-phenoxyanilino)pyridazine-3-carboxamide
CID 109115485
3-chloro-6-phenoxypyridazine;3,6-dichloropyridazine
CID 87882017
5-N-(2-methoxyphenyl)-3-N-(2-phenoxyphenyl)-1,2,4-triazine-3,5-diamine
CID 112967105
6-methyl-4-N-(2-phenoxyphenyl)-2-N-phenylpyrimidine-2,4-diamine
CID 112926974
6-chloro-N-[3-(trifluoromethoxy)phenyl]pyridazin-3-amine
CID 43151729

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2-phenoxyphenyl)pyridazin-3-amine?
The IUPAC name of 6-chloro-N-(2-phenoxyphenyl)pyridazin-3-amine (CID 43329642) is 6-chloro-N-(2-phenoxyphenyl)pyridazin-3-amine.
What is the SMILES notation for 6-chloro-N-(2-phenoxyphenyl)pyridazin-3-amine?
The canonical SMILES for 6-chloro-N-(2-phenoxyphenyl)pyridazin-3-amine is Clc1ccc(Nc2ccccc2Oc2ccccc2)nn1.
What is the InChIKey of 6-chloro-N-(2-phenoxyphenyl)pyridazin-3-amine?
The InChIKey is ZQXHSPUQVMITFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12ClN3O/c17-15-10-11-16(20-19-15)18-13-8-4-5-9-14(13)21-12-6-2-1-3-7-12/h1-11H,(H,18,20).
What are the key properties of 6-chloro-N-(2-phenoxyphenyl)pyridazin-3-amine?
6-chloro-N-(2-phenoxyphenyl)pyridazin-3-amine has a molecular weight of 297.75 g/mol, XLogP of 4.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2-phenoxyphenyl)pyridazin-3-amine is sourced from PubChem (CID 43329642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).