3-ethyl-5,7-dimethoxy-2-methylquinolin-4-amine

C14H18N2O2 — CID 62203590

IUPAC3-ethyl-5,7-dimethoxy-2-methylquinolin-4-amine
SMILESCCc1c(C)nc2cc(OC)cc(OC)c2c1N
InChIInChI=1S/C14H18N2O2/c1-5-10-8(2)16-11-6-9(17-3)7-12(18-4)13(11)14(10)15/h6-7H,5H2,1-4H3,(H2,15,16)
InChIKeyJIWWQRQOAXDKKS-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.71
Rot. Bonds3

About 3-ethyl-5,7-dimethoxy-2-methylquinolin-4-amine

3-ethyl-5,7-dimethoxy-2-methylquinolin-4-amine (PubChem CID 62203590) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 3-ethyl-5,7-dimethoxy-2-methylquinolin-4-amine.

Molecular Properties

Compound Name3-ethyl-5,7-dimethoxy-2-methylquinolin-4-amine
PubChem CID62203590
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name3-ethyl-5,7-dimethoxy-2-methylquinolin-4-amine
SMILESCCc1c(C)nc2cc(OC)cc(OC)c2c1N
InChIInChI=1S/C14H18N2O2/c1-5-10-8(2)16-11-6-9(17-3)7-12(18-4)13(11)14(10)15/h6-7H,5H2,1-4H3,(H2,15,16)
InChIKeyJIWWQRQOAXDKKS-UHFFFAOYSA-N
XLogP2.71
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5,7-dimethoxy-2-methylquinolin-4-amine?
The IUPAC name of 3-ethyl-5,7-dimethoxy-2-methylquinolin-4-amine (CID 62203590) is 3-ethyl-5,7-dimethoxy-2-methylquinolin-4-amine.
What is the SMILES notation for 3-ethyl-5,7-dimethoxy-2-methylquinolin-4-amine?
The canonical SMILES for 3-ethyl-5,7-dimethoxy-2-methylquinolin-4-amine is CCc1c(C)nc2cc(OC)cc(OC)c2c1N.
What is the InChIKey of 3-ethyl-5,7-dimethoxy-2-methylquinolin-4-amine?
The InChIKey is JIWWQRQOAXDKKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-5-10-8(2)16-11-6-9(17-3)7-12(18-4)13(11)14(10)15/h6-7H,5H2,1-4H3,(H2,15,16).
What are the key properties of 3-ethyl-5,7-dimethoxy-2-methylquinolin-4-amine?
3-ethyl-5,7-dimethoxy-2-methylquinolin-4-amine has a molecular weight of 246.31 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5,7-dimethoxy-2-methylquinolin-4-amine is sourced from PubChem (CID 62203590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).