6-ethoxy-2-propan-2-yl-N-propylquinolin-4-amine

C17H24N2O — CID 63480542

IUPAC6-ethoxy-2-propan-2-yl-N-propylquinolin-4-amine
SMILESCCCNc1cc(C(C)C)nc2ccc(OCC)cc12
InChIInChI=1S/C17H24N2O/c1-5-9-18-17-11-16(12(3)4)19-15-8-7-13(20-6-2)10-14(15)17/h7-8,10-12H,5-6,9H2,1-4H3,(H,18,19)
InChIKeyQUINLYWLEZBHDT-UHFFFAOYSA-N
MW272.39 g/mol
LogP4.58
Rot. Bonds6

About 6-ethoxy-2-propan-2-yl-N-propylquinolin-4-amine

6-ethoxy-2-propan-2-yl-N-propylquinolin-4-amine (PubChem CID 63480542) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is 6-ethoxy-2-propan-2-yl-N-propylquinolin-4-amine.

Molecular Properties

Compound Name6-ethoxy-2-propan-2-yl-N-propylquinolin-4-amine
PubChem CID63480542
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC Name6-ethoxy-2-propan-2-yl-N-propylquinolin-4-amine
SMILESCCCNc1cc(C(C)C)nc2ccc(OCC)cc12
InChIInChI=1S/C17H24N2O/c1-5-9-18-17-11-16(12(3)4)19-15-8-7-13(20-6-2)10-14(15)17/h7-8,10-12H,5-6,9H2,1-4H3,(H,18,19)
InChIKeyQUINLYWLEZBHDT-UHFFFAOYSA-N
XLogP4.58
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-2-propan-2-yl-N-propylquinolin-4-amine?
The IUPAC name of 6-ethoxy-2-propan-2-yl-N-propylquinolin-4-amine (CID 63480542) is 6-ethoxy-2-propan-2-yl-N-propylquinolin-4-amine.
What is the SMILES notation for 6-ethoxy-2-propan-2-yl-N-propylquinolin-4-amine?
The canonical SMILES for 6-ethoxy-2-propan-2-yl-N-propylquinolin-4-amine is CCCNc1cc(C(C)C)nc2ccc(OCC)cc12.
What is the InChIKey of 6-ethoxy-2-propan-2-yl-N-propylquinolin-4-amine?
The InChIKey is QUINLYWLEZBHDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-5-9-18-17-11-16(12(3)4)19-15-8-7-13(20-6-2)10-14(15)17/h7-8,10-12H,5-6,9H2,1-4H3,(H,18,19).
What are the key properties of 6-ethoxy-2-propan-2-yl-N-propylquinolin-4-amine?
6-ethoxy-2-propan-2-yl-N-propylquinolin-4-amine has a molecular weight of 272.39 g/mol, XLogP of 4.58, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-2-propan-2-yl-N-propylquinolin-4-amine is sourced from PubChem (CID 63480542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).