6-(4,7-dimethoxy-8-methylquinolin-2-yl)-N-propan-2-ylpyridin-2-amine

C20H23N3O2 — CID 70836068

IUPAC6-(4,7-dimethoxy-8-methylquinolin-2-yl)-N-propan-2-ylpyridin-2-amine
SMILESCOc1ccc2c(OC)cc(-c3cccc(NC(C)C)n3)nc2c1C
InChIInChI=1S/C20H23N3O2/c1-12(2)21-19-8-6-7-15(22-19)16-11-18(25-5)14-9-10-17(24-4)13(3)20(14)23-16/h6-12H,1-5H3,(H,21,22)
InChIKeyXGWKSXVXILENHN-UHFFFAOYSA-N
MW337.42 g/mol
LogP4.44
Rot. Bonds5

About 6-(4,7-dimethoxy-8-methylquinolin-2-yl)-N-propan-2-ylpyridin-2-amine

6-(4,7-dimethoxy-8-methylquinolin-2-yl)-N-propan-2-ylpyridin-2-amine (PubChem CID 70836068) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is 6-(4,7-dimethoxy-8-methylquinolin-2-yl)-N-propan-2-ylpyridin-2-amine.

Molecular Properties

Compound Name6-(4,7-dimethoxy-8-methylquinolin-2-yl)-N-propan-2-ylpyridin-2-amine
PubChem CID70836068
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC Name6-(4,7-dimethoxy-8-methylquinolin-2-yl)-N-propan-2-ylpyridin-2-amine
SMILESCOc1ccc2c(OC)cc(-c3cccc(NC(C)C)n3)nc2c1C
InChIInChI=1S/C20H23N3O2/c1-12(2)21-19-8-6-7-15(22-19)16-11-18(25-5)14-9-10-17(24-4)13(3)20(14)23-16/h6-12H,1-5H3,(H,21,22)
InChIKeyXGWKSXVXILENHN-UHFFFAOYSA-N
XLogP4.44
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(4,7-dimethoxy-8-methylquinolin-2-yl)-N-propan-2-ylpyridin-2-amine?
The IUPAC name of 6-(4,7-dimethoxy-8-methylquinolin-2-yl)-N-propan-2-ylpyridin-2-amine (CID 70836068) is 6-(4,7-dimethoxy-8-methylquinolin-2-yl)-N-propan-2-ylpyridin-2-amine.
What is the SMILES notation for 6-(4,7-dimethoxy-8-methylquinolin-2-yl)-N-propan-2-ylpyridin-2-amine?
The canonical SMILES for 6-(4,7-dimethoxy-8-methylquinolin-2-yl)-N-propan-2-ylpyridin-2-amine is COc1ccc2c(OC)cc(-c3cccc(NC(C)C)n3)nc2c1C.
What is the InChIKey of 6-(4,7-dimethoxy-8-methylquinolin-2-yl)-N-propan-2-ylpyridin-2-amine?
The InChIKey is XGWKSXVXILENHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-12(2)21-19-8-6-7-15(22-19)16-11-18(25-5)14-9-10-17(24-4)13(3)20(14)23-16/h6-12H,1-5H3,(H,21,22).
What are the key properties of 6-(4,7-dimethoxy-8-methylquinolin-2-yl)-N-propan-2-ylpyridin-2-amine?
6-(4,7-dimethoxy-8-methylquinolin-2-yl)-N-propan-2-ylpyridin-2-amine has a molecular weight of 337.42 g/mol, XLogP of 4.44, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4,7-dimethoxy-8-methylquinolin-2-yl)-N-propan-2-ylpyridin-2-amine is sourced from PubChem (CID 70836068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).