4-[2-[4-(6,8-dimethoxyisoquinolin-3-yl)-2,6-dimethylphenoxy]ethyl]morpholine

C25H30N2O4 — CID 24957862

IUPAC4-[2-[4-(6,8-dimethoxyisoquinolin-3-yl)-2,6-dimethylphenoxy]ethyl]morpholine
SMILESCOc1cc(OC)c2cnc(-c3cc(C)c(OCCN4CCOCC4)c(C)c3)cc2c1
InChIInChI=1S/C25H30N2O4/c1-17-11-20(12-18(2)25(17)31-10-7-27-5-8-30-9-6-27)23-14-19-13-21(28-3)15-24(29-4)22(19)16-26-23/h11-16H,5-10H2,1-4H3
InChIKeyZVZWLDCQGSNBFB-UHFFFAOYSA-N
MW422.53 g/mol
LogP4.25
Rot. Bonds7

About 4-[2-[4-(6,8-dimethoxyisoquinolin-3-yl)-2,6-dimethylphenoxy]ethyl]morpholine

4-[2-[4-(6,8-dimethoxyisoquinolin-3-yl)-2,6-dimethylphenoxy]ethyl]morpholine (PubChem CID 24957862) has the molecular formula C25H30N2O4 and a molecular weight of 422.53 g/mol. Its IUPAC name is 4-[2-[4-(6,8-dimethoxyisoquinolin-3-yl)-2,6-dimethylphenoxy]ethyl]morpholine.

Molecular Properties

Compound Name4-[2-[4-(6,8-dimethoxyisoquinolin-3-yl)-2,6-dimethylphenoxy]ethyl]morpholine
PubChem CID24957862
Molecular FormulaC25H30N2O4
Molecular Weight422.53 g/mol
Exact Mass422.22
IUPAC Name4-[2-[4-(6,8-dimethoxyisoquinolin-3-yl)-2,6-dimethylphenoxy]ethyl]morpholine
SMILESCOc1cc(OC)c2cnc(-c3cc(C)c(OCCN4CCOCC4)c(C)c3)cc2c1
InChIInChI=1S/C25H30N2O4/c1-17-11-20(12-18(2)25(17)31-10-7-27-5-8-30-9-6-27)23-14-19-13-21(28-3)15-24(29-4)22(19)16-26-23/h11-16H,5-10H2,1-4H3
InChIKeyZVZWLDCQGSNBFB-UHFFFAOYSA-N
XLogP4.25
TPSA53.05 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.53
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-[2-[4-(6,8-dimethoxyisoquinolin-3-yl)-2,6-dimethylphenoxy]ethyl]morpholine 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

4-[2-(4-chloro-2,6-dimethylphenoxy)ethyl]morpholine
CID 872206
methyl 3,5-dimethoxy-4-(2-morpholin-4-ylethoxy)benzoate
CID 58976806
[3,5-dimethoxy-4-(2-morpholin-4-ylethoxy)phenyl]methanol
CID 43516741
4-[2-(2,6-dimethyl-4-propan-2-ylphenoxy)ethyl]morpholine
CID 20871910
4-[2-(4-methylnaphthalen-2-yl)oxyethyl]morpholine
CID 143504994
2-[3,5-dimethyl-4-(2-pyrrolidin-1-ylethoxy)phenyl]-6-methoxyquinazoline
CID 66745885
3-[3,5-dimethoxy-4-(2-morpholin-4-ylethoxy)phenyl]-2,5-dihydro-1H-1,2,4-triazin-6-one
CID 110187528
ethane;4-methoxy-1,2-dimethylbenzene;4-[2-(2-methylphenoxy)ethyl]morpholine
CID 143832588
4-[2-(2-chloro-4,6-dimethylphenoxy)ethyl]morpholine
CID 869403
2-[4-(4-methoxyphenyl)-5-methyl-1H-pyrazol-3-yl]-5-(2-morpholin-4-ylethoxy)phenol
CID 135656441
4-[3,5-dimethoxy-4-(2-morpholin-4-ylethoxy)phenyl]-N-(3-fluorophenyl)pyrimidin-2-amine
CID 10161321
[3-methoxy-5-(2-morpholin-4-ylethoxy)phenyl]methanol
CID 123642977

Frequently Asked Questions

What is the IUPAC name of 4-[2-[4-(6,8-dimethoxyisoquinolin-3-yl)-2,6-dimethylphenoxy]ethyl]morpholine?
The IUPAC name of 4-[2-[4-(6,8-dimethoxyisoquinolin-3-yl)-2,6-dimethylphenoxy]ethyl]morpholine (CID 24957862) is 4-[2-[4-(6,8-dimethoxyisoquinolin-3-yl)-2,6-dimethylphenoxy]ethyl]morpholine.
What is the SMILES notation for 4-[2-[4-(6,8-dimethoxyisoquinolin-3-yl)-2,6-dimethylphenoxy]ethyl]morpholine?
The canonical SMILES for 4-[2-[4-(6,8-dimethoxyisoquinolin-3-yl)-2,6-dimethylphenoxy]ethyl]morpholine is COc1cc(OC)c2cnc(-c3cc(C)c(OCCN4CCOCC4)c(C)c3)cc2c1.
What is the InChIKey of 4-[2-[4-(6,8-dimethoxyisoquinolin-3-yl)-2,6-dimethylphenoxy]ethyl]morpholine?
The InChIKey is ZVZWLDCQGSNBFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N2O4/c1-17-11-20(12-18(2)25(17)31-10-7-27-5-8-30-9-6-27)23-14-19-13-21(28-3)15-24(29-4)22(19)16-26-23/h11-16H,5-10H2,1-4H3.
What are the key properties of 4-[2-[4-(6,8-dimethoxyisoquinolin-3-yl)-2,6-dimethylphenoxy]ethyl]morpholine?
4-[2-[4-(6,8-dimethoxyisoquinolin-3-yl)-2,6-dimethylphenoxy]ethyl]morpholine has a molecular weight of 422.53 g/mol, XLogP of 4.25, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[4-(6,8-dimethoxyisoquinolin-3-yl)-2,6-dimethylphenoxy]ethyl]morpholine is sourced from PubChem (CID 24957862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).