4-(5-ethyl-2-methylmorpholin-4-yl)quinolin-8-amine

C16H21N3O — CID 83061254

IUPAC4-(5-ethyl-2-methylmorpholin-4-yl)quinolin-8-amine
SMILESCCC1COC(C)CN1c1ccnc2c(N)cccc12
InChIInChI=1S/C16H21N3O/c1-3-12-10-20-11(2)9-19(12)15-7-8-18-16-13(15)5-4-6-14(16)17/h4-8,11-12H,3,9-10,17H2,1-2H3
InChIKeyIEKPQVXMUIIUCC-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.82
Rot. Bonds2

About 4-(5-ethyl-2-methylmorpholin-4-yl)quinolin-8-amine

4-(5-ethyl-2-methylmorpholin-4-yl)quinolin-8-amine (PubChem CID 83061254) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is 4-(5-ethyl-2-methylmorpholin-4-yl)quinolin-8-amine.

Molecular Properties

Compound Name4-(5-ethyl-2-methylmorpholin-4-yl)quinolin-8-amine
PubChem CID83061254
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name4-(5-ethyl-2-methylmorpholin-4-yl)quinolin-8-amine
SMILESCCC1COC(C)CN1c1ccnc2c(N)cccc12
InChIInChI=1S/C16H21N3O/c1-3-12-10-20-11(2)9-19(12)15-7-8-18-16-13(15)5-4-6-14(16)17/h4-8,11-12H,3,9-10,17H2,1-2H3
InChIKeyIEKPQVXMUIIUCC-UHFFFAOYSA-N
XLogP2.82
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 4-(5-ethyl-2-methylmorpholin-4-yl)quinolin-8-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 4-(5-ethyl-2-methylmorpholin-4-yl)quinolin-8-amine?
The IUPAC name of 4-(5-ethyl-2-methylmorpholin-4-yl)quinolin-8-amine (CID 83061254) is 4-(5-ethyl-2-methylmorpholin-4-yl)quinolin-8-amine.
What is the SMILES notation for 4-(5-ethyl-2-methylmorpholin-4-yl)quinolin-8-amine?
The canonical SMILES for 4-(5-ethyl-2-methylmorpholin-4-yl)quinolin-8-amine is CCC1COC(C)CN1c1ccnc2c(N)cccc12.
What is the InChIKey of 4-(5-ethyl-2-methylmorpholin-4-yl)quinolin-8-amine?
The InChIKey is IEKPQVXMUIIUCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-3-12-10-20-11(2)9-19(12)15-7-8-18-16-13(15)5-4-6-14(16)17/h4-8,11-12H,3,9-10,17H2,1-2H3.
What are the key properties of 4-(5-ethyl-2-methylmorpholin-4-yl)quinolin-8-amine?
4-(5-ethyl-2-methylmorpholin-4-yl)quinolin-8-amine has a molecular weight of 271.36 g/mol, XLogP of 2.82, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-ethyl-2-methylmorpholin-4-yl)quinolin-8-amine is sourced from PubChem (CID 83061254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).