6-chloro-N-(2,6-dimethylphenyl)pyridazin-3-amine

C12H12ClN3 — CID 89493032

IUPAC6-chloro-N-(2,6-dimethylphenyl)pyridazin-3-amine
SMILESCc1cccc(C)c1Nc1ccc(Cl)nn1
InChIInChI=1S/C12H12ClN3/c1-8-4-3-5-9(2)12(8)14-11-7-6-10(13)15-16-11/h3-7H,1-2H3,(H,14,16)
InChIKeyNFRVJDOMNLBTNN-UHFFFAOYSA-N
MW233.70 g/mol
LogP3.49
Rot. Bonds2

About 6-chloro-N-(2,6-dimethylphenyl)pyridazin-3-amine

6-chloro-N-(2,6-dimethylphenyl)pyridazin-3-amine (PubChem CID 89493032) has the molecular formula C12H12ClN3 and a molecular weight of 233.70 g/mol. Its IUPAC name is 6-chloro-N-(2,6-dimethylphenyl)pyridazin-3-amine.

Molecular Properties

Compound Name6-chloro-N-(2,6-dimethylphenyl)pyridazin-3-amine
PubChem CID89493032
Molecular FormulaC12H12ClN3
Molecular Weight233.70 g/mol
Exact Mass233.07
IUPAC Name6-chloro-N-(2,6-dimethylphenyl)pyridazin-3-amine
SMILESCc1cccc(C)c1Nc1ccc(Cl)nn1
InChIInChI=1S/C12H12ClN3/c1-8-4-3-5-9(2)12(8)14-11-7-6-10(13)15-16-11/h3-7H,1-2H3,(H,14,16)
InChIKeyNFRVJDOMNLBTNN-UHFFFAOYSA-N
XLogP3.49
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.70
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-chloro-N-(4-chlorophenyl)pyridazin-3-amine
CID 617439
6-chloro-N-phenylpyridazin-3-amine
CID 6401740
N-benzyl-N-[6-(4-chloroanilino)-3-pyridazinyl]amine
CID 6414439
3-chloro-6-[3,6-dihydro-4-(3-methylphenyl)-1(2H)-pyridinyl]pyridazine
CID 6410416
N-(4-fluorobenzyl)-6-chloropyridazin-3-amine
CID 8105864
N-(3-chlorophenyl)-6-phenylpyridazin-3-amine
CID 57276806
6-chloro-N-(4-methylphenyl)pyridazin-3-amine
CID 6409839
6-methyl-N-(2-methylphenyl)-4-[3-(trifluoromethyl)phenyl]pyridazin-3-amine
CID 25022974
N-(3-chlorophenyl)-6-methyl-4-[3-(trifluoromethyl)phenyl]pyridazin-3-amine
CID 25023034
N-(4-chlorophenyl)-6-methyl-4-[3-(trifluoromethyl)phenyl]pyridazin-3-amine
CID 25023035
N-(2-chlorophenyl)-6-methyl-4-[3-(trifluoromethyl)phenyl]pyridazin-3-amine
CID 25023149
3-Benzidino-6-(4-chlorophenyl)pyridazine
CID 53412025

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2,6-dimethylphenyl)pyridazin-3-amine?
The IUPAC name of 6-chloro-N-(2,6-dimethylphenyl)pyridazin-3-amine (CID 89493032) is 6-chloro-N-(2,6-dimethylphenyl)pyridazin-3-amine.
What is the SMILES notation for 6-chloro-N-(2,6-dimethylphenyl)pyridazin-3-amine?
The canonical SMILES for 6-chloro-N-(2,6-dimethylphenyl)pyridazin-3-amine is Cc1cccc(C)c1Nc1ccc(Cl)nn1.
What is the InChIKey of 6-chloro-N-(2,6-dimethylphenyl)pyridazin-3-amine?
The InChIKey is NFRVJDOMNLBTNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12ClN3/c1-8-4-3-5-9(2)12(8)14-11-7-6-10(13)15-16-11/h3-7H,1-2H3,(H,14,16).
What are the key properties of 6-chloro-N-(2,6-dimethylphenyl)pyridazin-3-amine?
6-chloro-N-(2,6-dimethylphenyl)pyridazin-3-amine has a molecular weight of 233.70 g/mol, XLogP of 3.49, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2,6-dimethylphenyl)pyridazin-3-amine is sourced from PubChem (CID 89493032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).