5,8-diethoxy-3-methylquinolin-2-amine

C14H18N2O2 — CID 63232028

IUPAC5,8-diethoxy-3-methylquinolin-2-amine
SMILESCCOc1ccc(OCC)c2nc(N)c(C)cc12
InChIInChI=1S/C14H18N2O2/c1-4-17-11-6-7-12(18-5-2)13-10(11)8-9(3)14(15)16-13/h6-8H,4-5H2,1-3H3,(H2,15,16)
InChIKeyMIIGAACPHRKPHS-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.92
Rot. Bonds4

About 5,8-diethoxy-3-methylquinolin-2-amine

5,8-diethoxy-3-methylquinolin-2-amine (PubChem CID 63232028) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 5,8-diethoxy-3-methylquinolin-2-amine.

Molecular Properties

Compound Name5,8-diethoxy-3-methylquinolin-2-amine
PubChem CID63232028
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name5,8-diethoxy-3-methylquinolin-2-amine
SMILESCCOc1ccc(OCC)c2nc(N)c(C)cc12
InChIInChI=1S/C14H18N2O2/c1-4-17-11-6-7-12(18-5-2)13-10(11)8-9(3)14(15)16-13/h6-8H,4-5H2,1-3H3,(H2,15,16)
InChIKeyMIIGAACPHRKPHS-UHFFFAOYSA-N
XLogP2.92
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5,8-diethoxy-3-methylquinolin-2-amine?
The IUPAC name of 5,8-diethoxy-3-methylquinolin-2-amine (CID 63232028) is 5,8-diethoxy-3-methylquinolin-2-amine.
What is the SMILES notation for 5,8-diethoxy-3-methylquinolin-2-amine?
The canonical SMILES for 5,8-diethoxy-3-methylquinolin-2-amine is CCOc1ccc(OCC)c2nc(N)c(C)cc12.
What is the InChIKey of 5,8-diethoxy-3-methylquinolin-2-amine?
The InChIKey is MIIGAACPHRKPHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-4-17-11-6-7-12(18-5-2)13-10(11)8-9(3)14(15)16-13/h6-8H,4-5H2,1-3H3,(H2,15,16).
What are the key properties of 5,8-diethoxy-3-methylquinolin-2-amine?
5,8-diethoxy-3-methylquinolin-2-amine has a molecular weight of 246.31 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,8-diethoxy-3-methylquinolin-2-amine is sourced from PubChem (CID 63232028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).