[6-methoxy-1-(morpholine-4-carbonyl)indol-3-yl]-(3,4,5-trimethoxyphenyl)methanone

C24H26N2O7 — CID 10389245

IUPAC[6-methoxy-1-(morpholine-4-carbonyl)indol-3-yl]-(3,4,5-trimethoxyphenyl)methanone
SMILESCOc1ccc2c(C(=O)c3cc(OC)c(OC)c(OC)c3)cn(C(=O)N3CCOCC3)c2c1
InChIInChI=1S/C24H26N2O7/c1-29-16-5-6-17-18(14-26(19(17)13-16)24(28)25-7-9-33-10-8-25)22(27)15-11-20(30-2)23(32-4)21(12-15)31-3/h5-6,11-14H,7-10H2,1-4H3
InChIKeyJSCAMVZECWXVJZ-UHFFFAOYSA-N
MW454.48 g/mol
LogP3.21
Rot. Bonds6

About [6-methoxy-1-(morpholine-4-carbonyl)indol-3-yl]-(3,4,5-trimethoxyphenyl)methanone

[6-methoxy-1-(morpholine-4-carbonyl)indol-3-yl]-(3,4,5-trimethoxyphenyl)methanone (PubChem CID 10389245) has the molecular formula C24H26N2O7 and a molecular weight of 454.48 g/mol. Its IUPAC name is [6-methoxy-1-(morpholine-4-carbonyl)indol-3-yl]-(3,4,5-trimethoxyphenyl)methanone.

Molecular Properties

Compound Name[6-methoxy-1-(morpholine-4-carbonyl)indol-3-yl]-(3,4,5-trimethoxyphenyl)methanone
PubChem CID10389245
Molecular FormulaC24H26N2O7
Molecular Weight454.48 g/mol
Exact Mass454.17
IUPAC Name[6-methoxy-1-(morpholine-4-carbonyl)indol-3-yl]-(3,4,5-trimethoxyphenyl)methanone
SMILESCOc1ccc2c(C(=O)c3cc(OC)c(OC)c(OC)c3)cn(C(=O)N3CCOCC3)c2c1
InChIInChI=1S/C24H26N2O7/c1-29-16-5-6-17-18(14-26(19(17)13-16)24(28)25-7-9-33-10-8-25)22(27)15-11-20(30-2)23(32-4)21(12-15)31-3/h5-6,11-14H,7-10H2,1-4H3
InChIKeyJSCAMVZECWXVJZ-UHFFFAOYSA-N
XLogP3.21
TPSA88.46 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.48
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze [6-methoxy-1-(morpholine-4-carbonyl)indol-3-yl]-(3,4,5-trimethoxyphenyl)methanone 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-methoxy-1-(morpholine-4-carbonyl)indol-3-yl]-(3,4,5-trimethoxyphenyl)methanone?
The IUPAC name of [6-methoxy-1-(morpholine-4-carbonyl)indol-3-yl]-(3,4,5-trimethoxyphenyl)methanone (CID 10389245) is [6-methoxy-1-(morpholine-4-carbonyl)indol-3-yl]-(3,4,5-trimethoxyphenyl)methanone.
What is the SMILES notation for [6-methoxy-1-(morpholine-4-carbonyl)indol-3-yl]-(3,4,5-trimethoxyphenyl)methanone?
The canonical SMILES for [6-methoxy-1-(morpholine-4-carbonyl)indol-3-yl]-(3,4,5-trimethoxyphenyl)methanone is COc1ccc2c(C(=O)c3cc(OC)c(OC)c(OC)c3)cn(C(=O)N3CCOCC3)c2c1.
What is the InChIKey of [6-methoxy-1-(morpholine-4-carbonyl)indol-3-yl]-(3,4,5-trimethoxyphenyl)methanone?
The InChIKey is JSCAMVZECWXVJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O7/c1-29-16-5-6-17-18(14-26(19(17)13-16)24(28)25-7-9-33-10-8-25)22(27)15-11-20(30-2)23(32-4)21(12-15)31-3/h5-6,11-14H,7-10H2,1-4H3.
What are the key properties of [6-methoxy-1-(morpholine-4-carbonyl)indol-3-yl]-(3,4,5-trimethoxyphenyl)methanone?
[6-methoxy-1-(morpholine-4-carbonyl)indol-3-yl]-(3,4,5-trimethoxyphenyl)methanone has a molecular weight of 454.48 g/mol, XLogP of 3.21, 6 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methoxy-1-(morpholine-4-carbonyl)indol-3-yl]-(3,4,5-trimethoxyphenyl)methanone is sourced from PubChem (CID 10389245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).