3,6-dichloro-2-methylquinolin-4-amine

C10H8Cl2N2 — CID 121236621

IUPAC3,6-dichloro-2-methylquinolin-4-amine
SMILESCc1nc2ccc(Cl)cc2c(N)c1Cl
InChIInChI=1S/C10H8Cl2N2/c1-5-9(12)10(13)7-4-6(11)2-3-8(7)14-5/h2-4H,1H3,(H2,13,14)
InChIKeyVQFHYOYRROEXRW-UHFFFAOYSA-N
MW227.09 g/mol
LogP3.43
Rot. Bonds

About 3,6-dichloro-2-methylquinolin-4-amine

3,6-dichloro-2-methylquinolin-4-amine (PubChem CID 121236621) has the molecular formula C10H8Cl2N2 and a molecular weight of 227.09 g/mol. Its IUPAC name is 3,6-dichloro-2-methylquinolin-4-amine.

Molecular Properties

Compound Name3,6-dichloro-2-methylquinolin-4-amine
PubChem CID121236621
Molecular FormulaC10H8Cl2N2
Molecular Weight227.09 g/mol
Exact Mass226.01
IUPAC Name3,6-dichloro-2-methylquinolin-4-amine
SMILESCc1nc2ccc(Cl)cc2c(N)c1Cl
InChIInChI=1S/C10H8Cl2N2/c1-5-9(12)10(13)7-4-6(11)2-3-8(7)14-5/h2-4H,1H3,(H2,13,14)
InChIKeyVQFHYOYRROEXRW-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 3,6-dichloro-2-methylquinolin-4-amine?
The IUPAC name of 3,6-dichloro-2-methylquinolin-4-amine (CID 121236621) is 3,6-dichloro-2-methylquinolin-4-amine.
What is the SMILES notation for 3,6-dichloro-2-methylquinolin-4-amine?
The canonical SMILES for 3,6-dichloro-2-methylquinolin-4-amine is Cc1nc2ccc(Cl)cc2c(N)c1Cl.
What is the InChIKey of 3,6-dichloro-2-methylquinolin-4-amine?
The InChIKey is VQFHYOYRROEXRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Cl2N2/c1-5-9(12)10(13)7-4-6(11)2-3-8(7)14-5/h2-4H,1H3,(H2,13,14).
What are the key properties of 3,6-dichloro-2-methylquinolin-4-amine?
3,6-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 3,6-dichloro-2-methylquinolin-4-amine is sourced from PubChem (CID 121236621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).