4-chloro-N-methylquinolin-6-amine

C10H9ClN2 — CID 157043807

IUPAC4-chloro-N-methylquinolin-6-amine
SMILESCNc1ccc2nccc(Cl)c2c1
InChIInChI=1S/C10H9ClN2/c1-12-7-2-3-10-8(6-7)9(11)4-5-13-10/h2-6,12H,1H3
InChIKeyLJNZZGXPGBYNTE-UHFFFAOYSA-N
MW192.65 g/mol
LogP2.93
Rot. Bonds1

About 4-chloro-N-methylquinolin-6-amine

4-chloro-N-methylquinolin-6-amine (PubChem CID 157043807) has the molecular formula C10H9ClN2 and a molecular weight of 192.65 g/mol. Its IUPAC name is 4-chloro-N-methylquinolin-6-amine.

Molecular Properties

Compound Name4-chloro-N-methylquinolin-6-amine
PubChem CID157043807
Molecular FormulaC10H9ClN2
Molecular Weight192.65 g/mol
Exact Mass192.05
IUPAC Name4-chloro-N-methylquinolin-6-amine
SMILESCNc1ccc2nccc(Cl)c2c1
InChIInChI=1S/C10H9ClN2/c1-12-7-2-3-10-8(6-7)9(11)4-5-13-10/h2-6,12H,1H3
InChIKeyLJNZZGXPGBYNTE-UHFFFAOYSA-N
XLogP2.93
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.65
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-methylquinolin-6-amine?
The IUPAC name of 4-chloro-N-methylquinolin-6-amine (CID 157043807) is 4-chloro-N-methylquinolin-6-amine.
What is the SMILES notation for 4-chloro-N-methylquinolin-6-amine?
The canonical SMILES for 4-chloro-N-methylquinolin-6-amine is CNc1ccc2nccc(Cl)c2c1.
What is the InChIKey of 4-chloro-N-methylquinolin-6-amine?
The InChIKey is LJNZZGXPGBYNTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2/c1-12-7-2-3-10-8(6-7)9(11)4-5-13-10/h2-6,12H,1H3.
What are the key properties of 4-chloro-N-methylquinolin-6-amine?
4-chloro-N-methylquinolin-6-amine has a molecular weight of 192.65 g/mol, XLogP of 2.93, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-methylquinolin-6-amine is sourced from PubChem (CID 157043807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).