6-chloro-N-(4-chloro-2-methylphenyl)-4,5-dimethylpyridazin-3-amine

C13H13Cl2N3 — CID 114256276

IUPAC6-chloro-N-(4-chloro-2-methylphenyl)-4,5-dimethylpyridazin-3-amine
SMILESCc1cc(Cl)ccc1Nc1nnc(Cl)c(C)c1C
InChIInChI=1S/C13H13Cl2N3/c1-7-6-10(14)4-5-11(7)16-13-9(3)8(2)12(15)17-18-13/h4-6H,1-3H3,(H,16,18)
InChIKeyNQROLSNJKCOVSR-UHFFFAOYSA-N
MW282.17 g/mol
LogP4.45
Rot. Bonds2

About 6-chloro-N-(4-chloro-2-methylphenyl)-4,5-dimethylpyridazin-3-amine

6-chloro-N-(4-chloro-2-methylphenyl)-4,5-dimethylpyridazin-3-amine (PubChem CID 114256276) has the molecular formula C13H13Cl2N3 and a molecular weight of 282.17 g/mol. Its IUPAC name is 6-chloro-N-(4-chloro-2-methylphenyl)-4,5-dimethylpyridazin-3-amine.

Molecular Properties

Compound Name6-chloro-N-(4-chloro-2-methylphenyl)-4,5-dimethylpyridazin-3-amine
PubChem CID114256276
Molecular FormulaC13H13Cl2N3
Molecular Weight282.17 g/mol
Exact Mass281.05
IUPAC Name6-chloro-N-(4-chloro-2-methylphenyl)-4,5-dimethylpyridazin-3-amine
SMILESCc1cc(Cl)ccc1Nc1nnc(Cl)c(C)c1C
InChIInChI=1S/C13H13Cl2N3/c1-7-6-10(14)4-5-11(7)16-13-9(3)8(2)12(15)17-18-13/h4-6H,1-3H3,(H,16,18)
InChIKeyNQROLSNJKCOVSR-UHFFFAOYSA-N
XLogP4.45
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.17
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-chloro-N-(4-methoxy-2-methylphenyl)-4,5-dimethylpyridazin-3-amine
CID 63272259
6-chloro-N-(2,4-difluorophenyl)-4,5-dimethylpyridazin-3-amine
CID 55169284
N-(2-bromo-3-chlorophenyl)-6-chloro-4,5-dimethylpyridazin-3-amine
CID 103480984
N-(4-chloro-2-methylphenyl)-4-methoxy-2-methylaniline
CID 139611066
methyl 2-[4-[(6-chloro-4,5-dimethylpyridazin-3-yl)amino]-3-fluorophenyl]acetate
CID 142487600
N-(4-chloro-2-methylphenyl)-2,6-dimethylaniline
CID 57056849
6-chloro-N-(3,5-difluorophenyl)-4,5-dimethylpyridazin-3-amine
CID 55169285
N-(4-bromophenyl)-6-chloro-4,5-dimethylpyridazin-3-amine
CID 63271712
3-(4-chloro-2-methylanilino)-5,6-diethylpyridazine-4-carbonitrile
CID 80508584
2-(4-chloro-2-methylanilino)pyridine-3-carboxamide
CID 901918
N-(4-chloro-2-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 14033151
[2-(4-chloro-2-methylanilino)-3-pyridinyl]methanol
CID 82087006

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(4-chloro-2-methylphenyl)-4,5-dimethylpyridazin-3-amine?
The IUPAC name of 6-chloro-N-(4-chloro-2-methylphenyl)-4,5-dimethylpyridazin-3-amine (CID 114256276) is 6-chloro-N-(4-chloro-2-methylphenyl)-4,5-dimethylpyridazin-3-amine.
What is the SMILES notation for 6-chloro-N-(4-chloro-2-methylphenyl)-4,5-dimethylpyridazin-3-amine?
The canonical SMILES for 6-chloro-N-(4-chloro-2-methylphenyl)-4,5-dimethylpyridazin-3-amine is Cc1cc(Cl)ccc1Nc1nnc(Cl)c(C)c1C.
What is the InChIKey of 6-chloro-N-(4-chloro-2-methylphenyl)-4,5-dimethylpyridazin-3-amine?
The InChIKey is NQROLSNJKCOVSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13Cl2N3/c1-7-6-10(14)4-5-11(7)16-13-9(3)8(2)12(15)17-18-13/h4-6H,1-3H3,(H,16,18).
What are the key properties of 6-chloro-N-(4-chloro-2-methylphenyl)-4,5-dimethylpyridazin-3-amine?
6-chloro-N-(4-chloro-2-methylphenyl)-4,5-dimethylpyridazin-3-amine has a molecular weight of 282.17 g/mol, XLogP of 4.45, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(4-chloro-2-methylphenyl)-4,5-dimethylpyridazin-3-amine is sourced from PubChem (CID 114256276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).