8-chloro-N-(3,4-dichlorophenyl)quinolin-2-amine

C15H9Cl3N2 — CID 175490590

IUPAC8-chloro-N-(3,4-dichlorophenyl)quinolin-2-amine
SMILESClc1ccc(Nc2ccc3cccc(Cl)c3n2)cc1Cl
InChIInChI=1S/C15H9Cl3N2/c16-11-6-5-10(8-13(11)18)19-14-7-4-9-2-1-3-12(17)15(9)20-14/h1-8H,(H,19,20)
InChIKeyMSKCKWSBMFHJAP-UHFFFAOYSA-N
MW323.61 g/mol
LogP5.94
Rot. Bonds2

About 8-chloro-N-(3,4-dichlorophenyl)quinolin-2-amine

8-chloro-N-(3,4-dichlorophenyl)quinolin-2-amine (PubChem CID 175490590) has the molecular formula C15H9Cl3N2 and a molecular weight of 323.61 g/mol. Its IUPAC name is 8-chloro-N-(3,4-dichlorophenyl)quinolin-2-amine.

Molecular Properties

Compound Name8-chloro-N-(3,4-dichlorophenyl)quinolin-2-amine
PubChem CID175490590
Molecular FormulaC15H9Cl3N2
Molecular Weight323.61 g/mol
Exact Mass321.98
IUPAC Name8-chloro-N-(3,4-dichlorophenyl)quinolin-2-amine
SMILESClc1ccc(Nc2ccc3cccc(Cl)c3n2)cc1Cl
InChIInChI=1S/C15H9Cl3N2/c16-11-6-5-10(8-13(11)18)19-14-7-4-9-2-1-3-12(17)15(9)20-14/h1-8H,(H,19,20)
InChIKeyMSKCKWSBMFHJAP-UHFFFAOYSA-N
XLogP5.94
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500323.61
LogP ≤ 55.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3-Chloroanilino)quinazoline
CID 128872
6-Chloro-2-piperazin-1-yl-quinoline
CID 10264015
Cyclohexanecarboxamide, N-(2-((3,4-dichlorophenyl)amino)-4-quinolinyl)-
CID 25191023
6-chloro-N-(3-chlorophenyl)quinazolin-4-amine
CID 5328819
N-(4-(4-(2,3-dichlorophenyl)piperazin-1-yl)butyl)quinolin-2-amine
CID 11511026
6-Chloro-4-(dichloromethyl)-2-phenylquinazoline
CID 617341
N-(6-Chloro-4-phenyl-quinazolin-2-yl)-guanidine
CID 24746808
(4-Chloro-phenyl)-(2-phenyl-quinazolin-4-yl)-amine
CID 10359377
7-Chloro-2-piperazin-1-ylquinoline
CID 21680423
N~2~-(4-chlorophenyl)-2,4-quinazolinediamine hydrochloride
CID 2953146
7-chloro-N-(4-fluorobenzyl)-4-methyl-2-quinolinamine
CID 3711195
(4-Chlorophenyl){2-[(4-chlorophenyl)amino]quinazolin-4-yl}amine
CID 1878549

Frequently Asked Questions

What is the IUPAC name of 8-chloro-N-(3,4-dichlorophenyl)quinolin-2-amine?
The IUPAC name of 8-chloro-N-(3,4-dichlorophenyl)quinolin-2-amine (CID 175490590) is 8-chloro-N-(3,4-dichlorophenyl)quinolin-2-amine.
What is the SMILES notation for 8-chloro-N-(3,4-dichlorophenyl)quinolin-2-amine?
The canonical SMILES for 8-chloro-N-(3,4-dichlorophenyl)quinolin-2-amine is Clc1ccc(Nc2ccc3cccc(Cl)c3n2)cc1Cl.
What is the InChIKey of 8-chloro-N-(3,4-dichlorophenyl)quinolin-2-amine?
The InChIKey is MSKCKWSBMFHJAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9Cl3N2/c16-11-6-5-10(8-13(11)18)19-14-7-4-9-2-1-3-12(17)15(9)20-14/h1-8H,(H,19,20).
What are the key properties of 8-chloro-N-(3,4-dichlorophenyl)quinolin-2-amine?
8-chloro-N-(3,4-dichlorophenyl)quinolin-2-amine has a molecular weight of 323.61 g/mol, XLogP of 5.94, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-N-(3,4-dichlorophenyl)quinolin-2-amine is sourced from PubChem (CID 175490590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).