(2,6-dimethylmorpholin-4-yl)-[3-(4-methoxyphenyl)-1,4-dimethylpyrrol-2-yl]methanone

C20H26N2O3 — CID 24880561

IUPAC(2,6-dimethylmorpholin-4-yl)-[3-(4-methoxyphenyl)-1,4-dimethylpyrrol-2-yl]methanone
SMILESCOc1ccc(-c2c(C)cn(C)c2C(=O)N2CC(C)OC(C)C2)cc1
InChIInChI=1S/C20H26N2O3/c1-13-10-21(4)19(18(13)16-6-8-17(24-5)9-7-16)20(23)22-11-14(2)25-15(3)12-22/h6-10,14-15H,11-12H2,1-5H3
InChIKeyLRSSQLMUKWXUHW-UHFFFAOYSA-N
MW342.44 g/mol
LogP3.26
Rot. Bonds3

About (2,6-dimethylmorpholin-4-yl)-[3-(4-methoxyphenyl)-1,4-dimethylpyrrol-2-yl]methanone

(2,6-dimethylmorpholin-4-yl)-[3-(4-methoxyphenyl)-1,4-dimethylpyrrol-2-yl]methanone (PubChem CID 24880561) has the molecular formula C20H26N2O3 and a molecular weight of 342.44 g/mol. Its IUPAC name is (2,6-dimethylmorpholin-4-yl)-[3-(4-methoxyphenyl)-1,4-dimethylpyrrol-2-yl]methanone.

Molecular Properties

Compound Name(2,6-dimethylmorpholin-4-yl)-[3-(4-methoxyphenyl)-1,4-dimethylpyrrol-2-yl]methanone
PubChem CID24880561
Molecular FormulaC20H26N2O3
Molecular Weight342.44 g/mol
Exact Mass342.19
IUPAC Name(2,6-dimethylmorpholin-4-yl)-[3-(4-methoxyphenyl)-1,4-dimethylpyrrol-2-yl]methanone
SMILESCOc1ccc(-c2c(C)cn(C)c2C(=O)N2CC(C)OC(C)C2)cc1
InChIInChI=1S/C20H26N2O3/c1-13-10-21(4)19(18(13)16-6-8-17(24-5)9-7-16)20(23)22-11-14(2)25-15(3)12-22/h6-10,14-15H,11-12H2,1-5H3
InChIKeyLRSSQLMUKWXUHW-UHFFFAOYSA-N
XLogP3.26
TPSA43.70 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (2,6-dimethylmorpholin-4-yl)-[3-(4-methoxyphenyl)-1,4-dimethylpyrrol-2-yl]methanone 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

(2,6-dimethylmorpholin-4-yl)-[3-(4-methoxyphenyl)-1-methylpyrazol-5-yl]methanone
CID 42759699
(2,6-dimethylmorpholin-4-yl)-[4-(4-methoxyphenyl)-5-methylthiophen-2-yl]methanone
CID 78774228
[(2R,6R)-2,6-dimethylmorpholin-4-yl]-[5-(4-methoxyphenyl)-2-methyl-1-(4-methylphenyl)pyrrol-3-yl]methanone
CID 7306681
(2,6-dimethylmorpholin-4-yl)-(6-methoxy-1H-indol-2-yl)methanone
CID 4870192
(2,5-dimethoxyphenyl)-[(2S,6S)-2,6-dimethylmorpholin-4-yl]methanone
CID 39910406
[2-(aminomethyl)-6-methylmorpholin-4-yl]-(4-methoxyphenyl)methanone
CID 102938451
(2,6-dimethylmorpholin-4-yl)-(7-methoxy-2-methylquinolin-3-yl)methanone
CID 42924708
(2,6-dimethylmorpholin-4-yl)-[3-(4-methoxyphenyl)-1-phenylpyrazol-5-yl]methanone
CID 42755284
[(2S,6S)-2,6-dimethylmorpholin-4-yl]-[2-(4-methoxyphenyl)quinolin-4-yl]methanone
CID 7693946
[(2R,6R)-2,6-dimethylmorpholin-4-yl]-[1-(4-fluorophenyl)-3-(4-methoxyphenyl)pyrazol-5-yl]methanone
CID 7328385
[(2S,6R)-2,6-dimethylmorpholin-4-yl]-[(5R)-3-(4-methoxyphenyl)-5-methyl-4H-1,2-oxazol-5-yl]methanone
CID 98882327
[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-(2,6-dimethylmorpholin-4-yl)methanone
CID 618918

Frequently Asked Questions

What is the IUPAC name of (2,6-dimethylmorpholin-4-yl)-[3-(4-methoxyphenyl)-1,4-dimethylpyrrol-2-yl]methanone?
The IUPAC name of (2,6-dimethylmorpholin-4-yl)-[3-(4-methoxyphenyl)-1,4-dimethylpyrrol-2-yl]methanone (CID 24880561) is (2,6-dimethylmorpholin-4-yl)-[3-(4-methoxyphenyl)-1,4-dimethylpyrrol-2-yl]methanone.
What is the SMILES notation for (2,6-dimethylmorpholin-4-yl)-[3-(4-methoxyphenyl)-1,4-dimethylpyrrol-2-yl]methanone?
The canonical SMILES for (2,6-dimethylmorpholin-4-yl)-[3-(4-methoxyphenyl)-1,4-dimethylpyrrol-2-yl]methanone is COc1ccc(-c2c(C)cn(C)c2C(=O)N2CC(C)OC(C)C2)cc1.
What is the InChIKey of (2,6-dimethylmorpholin-4-yl)-[3-(4-methoxyphenyl)-1,4-dimethylpyrrol-2-yl]methanone?
The InChIKey is LRSSQLMUKWXUHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3/c1-13-10-21(4)19(18(13)16-6-8-17(24-5)9-7-16)20(23)22-11-14(2)25-15(3)12-22/h6-10,14-15H,11-12H2,1-5H3.
What are the key properties of (2,6-dimethylmorpholin-4-yl)-[3-(4-methoxyphenyl)-1,4-dimethylpyrrol-2-yl]methanone?
(2,6-dimethylmorpholin-4-yl)-[3-(4-methoxyphenyl)-1,4-dimethylpyrrol-2-yl]methanone has a molecular weight of 342.44 g/mol, XLogP of 3.26, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethylmorpholin-4-yl)-[3-(4-methoxyphenyl)-1,4-dimethylpyrrol-2-yl]methanone is sourced from PubChem (CID 24880561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).