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

C14H15Cl2N3O2 — CID 63271923

IUPAC6-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-4,5-dimethylpyridazin-3-amine
SMILESCOc1cc(Nc2nnc(Cl)c(C)c2C)c(OC)cc1Cl
InChIInChI=1S/C14H15Cl2N3O2/c1-7-8(2)14(19-18-13(7)16)17-10-6-11(20-3)9(15)5-12(10)21-4/h5-6H,1-4H3,(H,17,19)
InChIKeyQXVRQOWALLAXOA-UHFFFAOYSA-N
MW328.20 g/mol
LogP4.16
Rot. Bonds4

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

6-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-4,5-dimethylpyridazin-3-amine (PubChem CID 63271923) has the molecular formula C14H15Cl2N3O2 and a molecular weight of 328.20 g/mol. Its IUPAC name is 6-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-4,5-dimethylpyridazin-3-amine.

Molecular Properties

Compound Name6-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-4,5-dimethylpyridazin-3-amine
PubChem CID63271923
Molecular FormulaC14H15Cl2N3O2
Molecular Weight328.20 g/mol
Exact Mass327.05
IUPAC Name6-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-4,5-dimethylpyridazin-3-amine
SMILESCOc1cc(Nc2nnc(Cl)c(C)c2C)c(OC)cc1Cl
InChIInChI=1S/C14H15Cl2N3O2/c1-7-8(2)14(19-18-13(7)16)17-10-6-11(20-3)9(15)5-12(10)21-4/h5-6H,1-4H3,(H,17,19)
InChIKeyQXVRQOWALLAXOA-UHFFFAOYSA-N
XLogP4.16
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.20
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-N-(4-chloro-2,5-dimethoxyphenyl)-2,5-dimethylpyrimidine-4,6-diamine
CID 80749225
3-bromo-N-(4-chloro-2,5-dimethoxyphenyl)-5-methylpyridin-2-amine
CID 105367588
6-chloro-N-(4-chloro-2,5-dimethoxyphenyl)pyridazin-3-amine
CID 43329630
5-bromo-N-(4-chloro-2,5-dimethoxyphenyl)pyrimidin-4-amine
CID 66340346
N-(4-chloro-2,5-dimethoxyphenyl)-2-hydrazinyl-5-methylpyrimidin-4-amine
CID 80913118
6-chloro-N-(4-chloro-2-methylphenyl)-4,5-dimethylpyridazin-3-amine
CID 114256276
4-N-(4-chloro-2,5-dimethoxyphenyl)-5-ethylpyrimidine-4,6-diamine
CID 80748285
2-N-(4-chloro-2,5-dimethoxyphenyl)-4-methylpyridine-2,5-diamine
CID 79173822
6-chloro-2-N-(4-chloro-2,5-dimethoxyphenyl)-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80749339
N-(4-chloro-2,5-dimethoxyphenyl)-5-fluoro-2-hydrazinylpyrimidin-4-amine
CID 80911429
N-(4-chloro-2,5-dimethoxyphenyl)-5-(1-chloroethyl)-1,3,4-oxadiazol-2-amine
CID 106958974
4-N-(4-chloro-2,5-dimethoxyphenyl)-6-hydrazinylpyrimidine-2,4-diamine
CID 80913116

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-4,5-dimethylpyridazin-3-amine?
The IUPAC name of 6-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-4,5-dimethylpyridazin-3-amine (CID 63271923) is 6-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-4,5-dimethylpyridazin-3-amine.
What is the SMILES notation for 6-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-4,5-dimethylpyridazin-3-amine?
The canonical SMILES for 6-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-4,5-dimethylpyridazin-3-amine is COc1cc(Nc2nnc(Cl)c(C)c2C)c(OC)cc1Cl.
What is the InChIKey of 6-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-4,5-dimethylpyridazin-3-amine?
The InChIKey is QXVRQOWALLAXOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15Cl2N3O2/c1-7-8(2)14(19-18-13(7)16)17-10-6-11(20-3)9(15)5-12(10)21-4/h5-6H,1-4H3,(H,17,19).
What are the key properties of 6-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-4,5-dimethylpyridazin-3-amine?
6-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-4,5-dimethylpyridazin-3-amine has a molecular weight of 328.20 g/mol, XLogP of 4.16, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(4-chloro-2,5-dimethoxyphenyl)-4,5-dimethylpyridazin-3-amine is sourced from PubChem (CID 63271923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).