6-phenoxy-N-propylquinolin-4-amine

C18H18N2O — CID 63485386

IUPAC6-phenoxy-N-propylquinolin-4-amine
SMILESCCCNc1ccnc2ccc(Oc3ccccc3)cc12
InChIInChI=1S/C18H18N2O/c1-2-11-19-18-10-12-20-17-9-8-15(13-16(17)18)21-14-6-4-3-5-7-14/h3-10,12-13H,2,11H2,1H3,(H,19,20)
InChIKeySEEVIGNPDXDZCC-UHFFFAOYSA-N
MW278.36 g/mol
LogP4.85
Rot. Bonds5

About 6-phenoxy-N-propylquinolin-4-amine

6-phenoxy-N-propylquinolin-4-amine (PubChem CID 63485386) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is 6-phenoxy-N-propylquinolin-4-amine.

Molecular Properties

Compound Name6-phenoxy-N-propylquinolin-4-amine
PubChem CID63485386
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC Name6-phenoxy-N-propylquinolin-4-amine
SMILESCCCNc1ccnc2ccc(Oc3ccccc3)cc12
InChIInChI=1S/C18H18N2O/c1-2-11-19-18-10-12-20-17-9-8-15(13-16(17)18)21-14-6-4-3-5-7-14/h3-10,12-13H,2,11H2,1H3,(H,19,20)
InChIKeySEEVIGNPDXDZCC-UHFFFAOYSA-N
XLogP4.85
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-phenoxy-N-propylquinolin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-phenoxy-N-propylquinolin-4-amine?
The IUPAC name of 6-phenoxy-N-propylquinolin-4-amine (CID 63485386) is 6-phenoxy-N-propylquinolin-4-amine.
What is the SMILES notation for 6-phenoxy-N-propylquinolin-4-amine?
The canonical SMILES for 6-phenoxy-N-propylquinolin-4-amine is CCCNc1ccnc2ccc(Oc3ccccc3)cc12.
What is the InChIKey of 6-phenoxy-N-propylquinolin-4-amine?
The InChIKey is SEEVIGNPDXDZCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-2-11-19-18-10-12-20-17-9-8-15(13-16(17)18)21-14-6-4-3-5-7-14/h3-10,12-13H,2,11H2,1H3,(H,19,20).
What are the key properties of 6-phenoxy-N-propylquinolin-4-amine?
6-phenoxy-N-propylquinolin-4-amine has a molecular weight of 278.36 g/mol, XLogP of 4.85, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-phenoxy-N-propylquinolin-4-amine is sourced from PubChem (CID 63485386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).