N,N-diethyl-2-[2-(4-propoxyphenyl)quinolin-4-yl]oxyethanamine

C24H30N2O2 — CID 53316933

IUPACN,N-diethyl-2-[2-(4-propoxyphenyl)quinolin-4-yl]oxyethanamine
SMILESCCCOc1ccc(-c2cc(OCCN(CC)CC)c3ccccc3n2)cc1
InChIInChI=1S/C24H30N2O2/c1-4-16-27-20-13-11-19(12-14-20)23-18-24(28-17-15-26(5-2)6-3)21-9-7-8-10-22(21)25-23/h7-14,18H,4-6,15-17H2,1-3H3
InChIKeySHIKXKJXWQEZOU-UHFFFAOYSA-N
MW378.52 g/mol
LogP5.41
Rot. Bonds10

About N,N-diethyl-2-[2-(4-propoxyphenyl)quinolin-4-yl]oxyethanamine

N,N-diethyl-2-[2-(4-propoxyphenyl)quinolin-4-yl]oxyethanamine (PubChem CID 53316933) has the molecular formula C24H30N2O2 and a molecular weight of 378.52 g/mol. Its IUPAC name is N,N-diethyl-2-[2-(4-propoxyphenyl)quinolin-4-yl]oxyethanamine.

Molecular Properties

Compound NameN,N-diethyl-2-[2-(4-propoxyphenyl)quinolin-4-yl]oxyethanamine
PubChem CID53316933
Molecular FormulaC24H30N2O2
Molecular Weight378.52 g/mol
Exact Mass378.23
IUPAC NameN,N-diethyl-2-[2-(4-propoxyphenyl)quinolin-4-yl]oxyethanamine
SMILESCCCOc1ccc(-c2cc(OCCN(CC)CC)c3ccccc3n2)cc1
InChIInChI=1S/C24H30N2O2/c1-4-16-27-20-13-11-19(12-14-20)23-18-24(28-17-15-26(5-2)6-3)21-9-7-8-10-22(21)25-23/h7-14,18H,4-6,15-17H2,1-3H3
InChIKeySHIKXKJXWQEZOU-UHFFFAOYSA-N
XLogP5.41
TPSA34.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.52
LogP ≤ 55.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N,N-diethyl-2-[2-(4-propoxyphenyl)quinolin-4-yl]oxyethanamine with MolForge

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

Launch Full Analysis

Related Compounds

Quinisocaine
CID 6857
Pipendoxifene
CID 6433099
Dimethisoquin Hydrochloride
CID 9883104
alpha-Pentyl-3-(2-quinolinylmethoxy)benzenemethanol
CID 5059
6-Methoxy-1,2,3,4-tetrahydroacridin-9-amine
CID 3075610
SB 714786
CID 10287730
9-Acridinamine, 1,2,3,4-tetrahydro-N-heptyl-6-methoxy-
CID 3075611
1-Acridinol, 1,2,3,4-tetrahydro-9-(((2-methoxyphenyl)methyl)amino)-
CID 3025616
2-(4-Methoxy-phenyl)-3-phenyl-quinoxaline
CID 687304
Ritolukast
CID 60539
SB-649,915
CID 10296414
9-Methoxyacridine
CID 99383

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[2-(4-propoxyphenyl)quinolin-4-yl]oxyethanamine?
The IUPAC name of N,N-diethyl-2-[2-(4-propoxyphenyl)quinolin-4-yl]oxyethanamine (CID 53316933) is N,N-diethyl-2-[2-(4-propoxyphenyl)quinolin-4-yl]oxyethanamine.
What is the SMILES notation for N,N-diethyl-2-[2-(4-propoxyphenyl)quinolin-4-yl]oxyethanamine?
The canonical SMILES for N,N-diethyl-2-[2-(4-propoxyphenyl)quinolin-4-yl]oxyethanamine is CCCOc1ccc(-c2cc(OCCN(CC)CC)c3ccccc3n2)cc1.
What is the InChIKey of N,N-diethyl-2-[2-(4-propoxyphenyl)quinolin-4-yl]oxyethanamine?
The InChIKey is SHIKXKJXWQEZOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N2O2/c1-4-16-27-20-13-11-19(12-14-20)23-18-24(28-17-15-26(5-2)6-3)21-9-7-8-10-22(21)25-23/h7-14,18H,4-6,15-17H2,1-3H3.
What are the key properties of N,N-diethyl-2-[2-(4-propoxyphenyl)quinolin-4-yl]oxyethanamine?
N,N-diethyl-2-[2-(4-propoxyphenyl)quinolin-4-yl]oxyethanamine has a molecular weight of 378.52 g/mol, XLogP of 5.41, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[2-(4-propoxyphenyl)quinolin-4-yl]oxyethanamine is sourced from PubChem (CID 53316933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).