5-chloro-3-(2-chlorophenyl)-N-methylquinoxalin-2-amine

C15H11Cl2N3 — CID 174610026

IUPAC5-chloro-3-(2-chlorophenyl)-N-methylquinoxalin-2-amine
SMILESCNc1nc2cccc(Cl)c2nc1-c1ccccc1Cl
InChIInChI=1S/C15H11Cl2N3/c1-18-15-13(9-5-2-3-6-10(9)16)20-14-11(17)7-4-8-12(14)19-15/h2-8H,1H3,(H,18,19)
InChIKeyWILOAGXYUGESQU-UHFFFAOYSA-N
MW304.18 g/mol
LogP4.65
Rot. Bonds2

About 5-chloro-3-(2-chlorophenyl)-N-methylquinoxalin-2-amine

5-chloro-3-(2-chlorophenyl)-N-methylquinoxalin-2-amine (PubChem CID 174610026) has the molecular formula C15H11Cl2N3 and a molecular weight of 304.18 g/mol. Its IUPAC name is 5-chloro-3-(2-chlorophenyl)-N-methylquinoxalin-2-amine.

Molecular Properties

Compound Name5-chloro-3-(2-chlorophenyl)-N-methylquinoxalin-2-amine
PubChem CID174610026
Molecular FormulaC15H11Cl2N3
Molecular Weight304.18 g/mol
Exact Mass303.03
IUPAC Name5-chloro-3-(2-chlorophenyl)-N-methylquinoxalin-2-amine
SMILESCNc1nc2cccc(Cl)c2nc1-c1ccccc1Cl
InChIInChI=1S/C15H11Cl2N3/c1-18-15-13(9-5-2-3-6-10(9)16)20-14-11(17)7-4-8-12(14)19-15/h2-8H,1H3,(H,18,19)
InChIKeyWILOAGXYUGESQU-UHFFFAOYSA-N
XLogP4.65
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.18
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-(2-chlorophenyl)-N-methylquinoxalin-2-amine?
The IUPAC name of 5-chloro-3-(2-chlorophenyl)-N-methylquinoxalin-2-amine (CID 174610026) is 5-chloro-3-(2-chlorophenyl)-N-methylquinoxalin-2-amine.
What is the SMILES notation for 5-chloro-3-(2-chlorophenyl)-N-methylquinoxalin-2-amine?
The canonical SMILES for 5-chloro-3-(2-chlorophenyl)-N-methylquinoxalin-2-amine is CNc1nc2cccc(Cl)c2nc1-c1ccccc1Cl.
What is the InChIKey of 5-chloro-3-(2-chlorophenyl)-N-methylquinoxalin-2-amine?
The InChIKey is WILOAGXYUGESQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2N3/c1-18-15-13(9-5-2-3-6-10(9)16)20-14-11(17)7-4-8-12(14)19-15/h2-8H,1H3,(H,18,19).
What are the key properties of 5-chloro-3-(2-chlorophenyl)-N-methylquinoxalin-2-amine?
5-chloro-3-(2-chlorophenyl)-N-methylquinoxalin-2-amine has a molecular weight of 304.18 g/mol, XLogP of 4.65, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-(2-chlorophenyl)-N-methylquinoxalin-2-amine is sourced from PubChem (CID 174610026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).