2-ethyl-6,8-dimethoxy-N-propylquinolin-4-amine

C16H22N2O2 — CID 63480277

IUPAC2-ethyl-6,8-dimethoxy-N-propylquinolin-4-amine
SMILESCCCNc1cc(CC)nc2c(OC)cc(OC)cc12
InChIInChI=1S/C16H22N2O2/c1-5-7-17-14-8-11(6-2)18-16-13(14)9-12(19-3)10-15(16)20-4/h8-10H,5-7H2,1-4H3,(H,17,18)
InChIKeyPMEFUCBMTKVCLE-UHFFFAOYSA-N
MW274.36 g/mol
LogP3.64
Rot. Bonds6

About 2-ethyl-6,8-dimethoxy-N-propylquinolin-4-amine

2-ethyl-6,8-dimethoxy-N-propylquinolin-4-amine (PubChem CID 63480277) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 2-ethyl-6,8-dimethoxy-N-propylquinolin-4-amine.

Molecular Properties

Compound Name2-ethyl-6,8-dimethoxy-N-propylquinolin-4-amine
PubChem CID63480277
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name2-ethyl-6,8-dimethoxy-N-propylquinolin-4-amine
SMILESCCCNc1cc(CC)nc2c(OC)cc(OC)cc12
InChIInChI=1S/C16H22N2O2/c1-5-7-17-14-8-11(6-2)18-16-13(14)9-12(19-3)10-15(16)20-4/h8-10H,5-7H2,1-4H3,(H,17,18)
InChIKeyPMEFUCBMTKVCLE-UHFFFAOYSA-N
XLogP3.64
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6,8-dimethoxy-N-propylquinolin-4-amine?
The IUPAC name of 2-ethyl-6,8-dimethoxy-N-propylquinolin-4-amine (CID 63480277) is 2-ethyl-6,8-dimethoxy-N-propylquinolin-4-amine.
What is the SMILES notation for 2-ethyl-6,8-dimethoxy-N-propylquinolin-4-amine?
The canonical SMILES for 2-ethyl-6,8-dimethoxy-N-propylquinolin-4-amine is CCCNc1cc(CC)nc2c(OC)cc(OC)cc12.
What is the InChIKey of 2-ethyl-6,8-dimethoxy-N-propylquinolin-4-amine?
The InChIKey is PMEFUCBMTKVCLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-5-7-17-14-8-11(6-2)18-16-13(14)9-12(19-3)10-15(16)20-4/h8-10H,5-7H2,1-4H3,(H,17,18).
What are the key properties of 2-ethyl-6,8-dimethoxy-N-propylquinolin-4-amine?
2-ethyl-6,8-dimethoxy-N-propylquinolin-4-amine has a molecular weight of 274.36 g/mol, XLogP of 3.64, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6,8-dimethoxy-N-propylquinolin-4-amine is sourced from PubChem (CID 63480277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).