7,8-dichloro-2-methylquinolin-4-amine

C10H8Cl2N2 — CID 17039646

IUPAC7,8-dichloro-2-methylquinolin-4-amine
SMILESCc1cc(N)c2ccc(Cl)c(Cl)c2n1
InChIInChI=1S/C10H8Cl2N2/c1-5-4-8(13)6-2-3-7(11)9(12)10(6)14-5/h2-4H,1H3,(H2,13,14)
InChIKeyYOXFYSBUBIJKKS-UHFFFAOYSA-N
MW227.09 g/mol
LogP3.43
Rot. Bonds

About 7,8-dichloro-2-methylquinolin-4-amine

7,8-dichloro-2-methylquinolin-4-amine (PubChem CID 17039646) has the molecular formula C10H8Cl2N2 and a molecular weight of 227.09 g/mol. Its IUPAC name is 7,8-dichloro-2-methylquinolin-4-amine.

Molecular Properties

Compound Name7,8-dichloro-2-methylquinolin-4-amine
PubChem CID17039646
Molecular FormulaC10H8Cl2N2
Molecular Weight227.09 g/mol
Exact Mass226.01
IUPAC Name7,8-dichloro-2-methylquinolin-4-amine
SMILESCc1cc(N)c2ccc(Cl)c(Cl)c2n1
InChIInChI=1S/C10H8Cl2N2/c1-5-4-8(13)6-2-3-7(11)9(12)10(6)14-5/h2-4H,1H3,(H2,13,14)
InChIKeyYOXFYSBUBIJKKS-UHFFFAOYSA-N
XLogP3.43
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.09
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7,8-dichloro-2-methylquinolin-4-amine?
The IUPAC name of 7,8-dichloro-2-methylquinolin-4-amine (CID 17039646) is 7,8-dichloro-2-methylquinolin-4-amine.
What is the SMILES notation for 7,8-dichloro-2-methylquinolin-4-amine?
The canonical SMILES for 7,8-dichloro-2-methylquinolin-4-amine is Cc1cc(N)c2ccc(Cl)c(Cl)c2n1.
What is the InChIKey of 7,8-dichloro-2-methylquinolin-4-amine?
The InChIKey is YOXFYSBUBIJKKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Cl2N2/c1-5-4-8(13)6-2-3-7(11)9(12)10(6)14-5/h2-4H,1H3,(H2,13,14).
What are the key properties of 7,8-dichloro-2-methylquinolin-4-amine?
7,8-dichloro-2-methylquinolin-4-amine has a molecular weight of 227.09 g/mol, XLogP of 3.43, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dichloro-2-methylquinolin-4-amine is sourced from PubChem (CID 17039646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).