4-chloro-6,7-dimethoxyquinolin-2-amine

C11H11ClN2O2 — CID 141028770

IUPAC4-chloro-6,7-dimethoxyquinolin-2-amine
SMILESCOc1cc2nc(N)cc(Cl)c2cc1OC
InChIInChI=1S/C11H11ClN2O2/c1-15-9-3-6-7(12)4-11(13)14-8(6)5-10(9)16-2/h3-5H,1-2H3,(H2,13,14)
InChIKeyREZFCXRGLPZHTE-UHFFFAOYSA-N
MW238.67 g/mol
LogP2.49
Rot. Bonds2

About 4-chloro-6,7-dimethoxyquinolin-2-amine

4-chloro-6,7-dimethoxyquinolin-2-amine (PubChem CID 141028770) has the molecular formula C11H11ClN2O2 and a molecular weight of 238.67 g/mol. Its IUPAC name is 4-chloro-6,7-dimethoxyquinolin-2-amine.

Molecular Properties

Compound Name4-chloro-6,7-dimethoxyquinolin-2-amine
PubChem CID141028770
Molecular FormulaC11H11ClN2O2
Molecular Weight238.67 g/mol
Exact Mass238.05
IUPAC Name4-chloro-6,7-dimethoxyquinolin-2-amine
SMILESCOc1cc2nc(N)cc(Cl)c2cc1OC
InChIInChI=1S/C11H11ClN2O2/c1-15-9-3-6-7(12)4-11(13)14-8(6)5-10(9)16-2/h3-5H,1-2H3,(H2,13,14)
InChIKeyREZFCXRGLPZHTE-UHFFFAOYSA-N
XLogP2.49
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.67
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-6,7-dimethoxyquinolin-2-amine?
The IUPAC name of 4-chloro-6,7-dimethoxyquinolin-2-amine (CID 141028770) is 4-chloro-6,7-dimethoxyquinolin-2-amine.
What is the SMILES notation for 4-chloro-6,7-dimethoxyquinolin-2-amine?
The canonical SMILES for 4-chloro-6,7-dimethoxyquinolin-2-amine is COc1cc2nc(N)cc(Cl)c2cc1OC.
What is the InChIKey of 4-chloro-6,7-dimethoxyquinolin-2-amine?
The InChIKey is REZFCXRGLPZHTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClN2O2/c1-15-9-3-6-7(12)4-11(13)14-8(6)5-10(9)16-2/h3-5H,1-2H3,(H2,13,14).
What are the key properties of 4-chloro-6,7-dimethoxyquinolin-2-amine?
4-chloro-6,7-dimethoxyquinolin-2-amine has a molecular weight of 238.67 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6,7-dimethoxyquinolin-2-amine is sourced from PubChem (CID 141028770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).