6-chloro-N-(3-iodophenyl)pyridazin-3-amine

C10H7ClIN3 — CID 43090226

IUPAC6-chloro-N-(3-iodophenyl)pyridazin-3-amine
SMILESClc1ccc(Nc2cccc(I)c2)nn1
InChIInChI=1S/C10H7ClIN3/c11-9-4-5-10(15-14-9)13-8-3-1-2-7(12)6-8/h1-6H,(H,13,15)
InChIKeyWHXDDRVKNFJDNW-UHFFFAOYSA-N
MW331.54 g/mol
LogP3.48
Rot. Bonds2

About 6-chloro-N-(3-iodophenyl)pyridazin-3-amine

6-chloro-N-(3-iodophenyl)pyridazin-3-amine (PubChem CID 43090226) has the molecular formula C10H7ClIN3 and a molecular weight of 331.54 g/mol. Its IUPAC name is 6-chloro-N-(3-iodophenyl)pyridazin-3-amine.

Molecular Properties

Compound Name6-chloro-N-(3-iodophenyl)pyridazin-3-amine
PubChem CID43090226
Molecular FormulaC10H7ClIN3
Molecular Weight331.54 g/mol
Exact Mass330.94
IUPAC Name6-chloro-N-(3-iodophenyl)pyridazin-3-amine
SMILESClc1ccc(Nc2cccc(I)c2)nn1
InChIInChI=1S/C10H7ClIN3/c11-9-4-5-10(15-14-9)13-8-3-1-2-7(12)6-8/h1-6H,(H,13,15)
InChIKeyWHXDDRVKNFJDNW-UHFFFAOYSA-N
XLogP3.48
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.54
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-chloro-N-(3-propan-2-ylphenyl)pyridazin-3-amine
CID 43090207
5-chloro-N-(3-iodophenyl)pyridin-2-amine
CID 66220543
6-chloro-N-[3-(trifluoromethoxy)phenyl]pyridazin-3-amine
CID 43151729
6-chloro-N-(3,4-difluorophenyl)pyridazin-3-amine
CID 43151751
6-chloro-N-(4-methylphenyl)pyridazin-3-amine
CID 6409839
6-chloro-N-pyrimidin-5-ylpyridazin-3-amine
CID 155284638
N-(3-chlorophenyl)-6-hydrazinylpyridazin-3-amine
CID 59363292
2-chloro-4-(3-iodoanilino)benzenecarbothioamide
CID 62948621
3-chloro-2-N-(3-iodophenyl)benzene-1,2-diamine
CID 29067112
N-(3-chlorophenyl)-4-iodopyridin-2-amine
CID 86236330
3-iodo-N-methylaniline
CID 11075306
3,5-dichloro-6-hydrazinyl-N-(3-iodophenyl)pyridin-2-amine
CID 102762322

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(3-iodophenyl)pyridazin-3-amine?
The IUPAC name of 6-chloro-N-(3-iodophenyl)pyridazin-3-amine (CID 43090226) is 6-chloro-N-(3-iodophenyl)pyridazin-3-amine.
What is the SMILES notation for 6-chloro-N-(3-iodophenyl)pyridazin-3-amine?
The canonical SMILES for 6-chloro-N-(3-iodophenyl)pyridazin-3-amine is Clc1ccc(Nc2cccc(I)c2)nn1.
What is the InChIKey of 6-chloro-N-(3-iodophenyl)pyridazin-3-amine?
The InChIKey is WHXDDRVKNFJDNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClIN3/c11-9-4-5-10(15-14-9)13-8-3-1-2-7(12)6-8/h1-6H,(H,13,15).
What are the key properties of 6-chloro-N-(3-iodophenyl)pyridazin-3-amine?
6-chloro-N-(3-iodophenyl)pyridazin-3-amine has a molecular weight of 331.54 g/mol, XLogP of 3.48, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(3-iodophenyl)pyridazin-3-amine is sourced from PubChem (CID 43090226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).