6-chloro-N,2,3,8-tetramethylquinolin-4-amine

C13H15ClN2 — CID 62195933

IUPAC6-chloro-N,2,3,8-tetramethylquinolin-4-amine
SMILESCNc1c(C)c(C)nc2c(C)cc(Cl)cc12
InChIInChI=1S/C13H15ClN2/c1-7-5-10(14)6-11-12(7)16-9(3)8(2)13(11)15-4/h5-6H,1-4H3,(H,15,16)
InChIKeyKZUCLSHZLKJIED-UHFFFAOYSA-N
MW234.73 g/mol
LogP3.86
Rot. Bonds1

About 6-chloro-N,2,3,8-tetramethylquinolin-4-amine

6-chloro-N,2,3,8-tetramethylquinolin-4-amine (PubChem CID 62195933) has the molecular formula C13H15ClN2 and a molecular weight of 234.73 g/mol. Its IUPAC name is 6-chloro-N,2,3,8-tetramethylquinolin-4-amine.

Molecular Properties

Compound Name6-chloro-N,2,3,8-tetramethylquinolin-4-amine
PubChem CID62195933
Molecular FormulaC13H15ClN2
Molecular Weight234.73 g/mol
Exact Mass234.09
IUPAC Name6-chloro-N,2,3,8-tetramethylquinolin-4-amine
SMILESCNc1c(C)c(C)nc2c(C)cc(Cl)cc12
InChIInChI=1S/C13H15ClN2/c1-7-5-10(14)6-11-12(7)16-9(3)8(2)13(11)15-4/h5-6H,1-4H3,(H,15,16)
InChIKeyKZUCLSHZLKJIED-UHFFFAOYSA-N
XLogP3.86
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.73
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N,2,3,8-tetramethylquinolin-4-amine?
The IUPAC name of 6-chloro-N,2,3,8-tetramethylquinolin-4-amine (CID 62195933) is 6-chloro-N,2,3,8-tetramethylquinolin-4-amine.
What is the SMILES notation for 6-chloro-N,2,3,8-tetramethylquinolin-4-amine?
The canonical SMILES for 6-chloro-N,2,3,8-tetramethylquinolin-4-amine is CNc1c(C)c(C)nc2c(C)cc(Cl)cc12.
What is the InChIKey of 6-chloro-N,2,3,8-tetramethylquinolin-4-amine?
The InChIKey is KZUCLSHZLKJIED-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN2/c1-7-5-10(14)6-11-12(7)16-9(3)8(2)13(11)15-4/h5-6H,1-4H3,(H,15,16).
What are the key properties of 6-chloro-N,2,3,8-tetramethylquinolin-4-amine?
6-chloro-N,2,3,8-tetramethylquinolin-4-amine has a molecular weight of 234.73 g/mol, XLogP of 3.86, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N,2,3,8-tetramethylquinolin-4-amine is sourced from PubChem (CID 62195933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).