2-(4-methoxyanilino)-4-methylquinolin-7-ol

C17H16N2O2 — CID 135472797

IUPAC2-(4-methoxyanilino)-4-methylquinolin-7-ol
SMILESCOc1ccc(Nc2cc(C)c3ccc(O)cc3n2)cc1
InChIInChI=1S/C17H16N2O2/c1-11-9-17(18-12-3-6-14(21-2)7-4-12)19-16-10-13(20)5-8-15(11)16/h3-10,20H,1-2H3,(H,18,19)
InChIKeyVSTQHVUEYSKIPX-UHFFFAOYSA-N
MW280.33 g/mol
LogP4.00
Rot. Bonds3

About 2-(4-methoxyanilino)-4-methylquinolin-7-ol

2-(4-methoxyanilino)-4-methylquinolin-7-ol (PubChem CID 135472797) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is 2-(4-methoxyanilino)-4-methylquinolin-7-ol.

Molecular Properties

Compound Name2-(4-methoxyanilino)-4-methylquinolin-7-ol
PubChem CID135472797
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC Name2-(4-methoxyanilino)-4-methylquinolin-7-ol
SMILESCOc1ccc(Nc2cc(C)c3ccc(O)cc3n2)cc1
InChIInChI=1S/C17H16N2O2/c1-11-9-17(18-12-3-6-14(21-2)7-4-12)19-16-10-13(20)5-8-15(11)16/h3-10,20H,1-2H3,(H,18,19)
InChIKeyVSTQHVUEYSKIPX-UHFFFAOYSA-N
XLogP4.00
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyanilino)-4-methylquinolin-7-ol?
The IUPAC name of 2-(4-methoxyanilino)-4-methylquinolin-7-ol (CID 135472797) is 2-(4-methoxyanilino)-4-methylquinolin-7-ol.
What is the SMILES notation for 2-(4-methoxyanilino)-4-methylquinolin-7-ol?
The canonical SMILES for 2-(4-methoxyanilino)-4-methylquinolin-7-ol is COc1ccc(Nc2cc(C)c3ccc(O)cc3n2)cc1.
What is the InChIKey of 2-(4-methoxyanilino)-4-methylquinolin-7-ol?
The InChIKey is VSTQHVUEYSKIPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c1-11-9-17(18-12-3-6-14(21-2)7-4-12)19-16-10-13(20)5-8-15(11)16/h3-10,20H,1-2H3,(H,18,19).
What are the key properties of 2-(4-methoxyanilino)-4-methylquinolin-7-ol?
2-(4-methoxyanilino)-4-methylquinolin-7-ol has a molecular weight of 280.33 g/mol, XLogP of 4.00, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyanilino)-4-methylquinolin-7-ol is sourced from PubChem (CID 135472797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).