[7-methoxy-1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone

C26H26N2O3 — CID 71680724

IUPAC[7-methoxy-1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone
SMILESCOc1cccc2c(C(=O)c3cccc4ccccc34)cn(CCN3CCOCC3)c12
InChIInChI=1S/C26H26N2O3/c1-30-24-11-5-9-21-23(18-28(25(21)24)13-12-27-14-16-31-17-15-27)26(29)22-10-4-7-19-6-2-3-8-20(19)22/h2-11,18H,12-17H2,1H3
InChIKeyJBUVJMMEQOHCHV-UHFFFAOYSA-N
MW414.51 g/mol
LogP4.37
Rot. Bonds6

About [7-methoxy-1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone

[7-methoxy-1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone (PubChem CID 71680724) has the molecular formula C26H26N2O3 and a molecular weight of 414.51 g/mol. Its IUPAC name is [7-methoxy-1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone.

Molecular Properties

Compound Name[7-methoxy-1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone
PubChem CID71680724
Molecular FormulaC26H26N2O3
Molecular Weight414.51 g/mol
Exact Mass414.19
IUPAC Name[7-methoxy-1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone
SMILESCOc1cccc2c(C(=O)c3cccc4ccccc34)cn(CCN3CCOCC3)c12
InChIInChI=1S/C26H26N2O3/c1-30-24-11-5-9-21-23(18-28(25(21)24)13-12-27-14-16-31-17-15-27)26(29)22-10-4-7-19-6-2-3-8-20(19)22/h2-11,18H,12-17H2,1H3
InChIKeyJBUVJMMEQOHCHV-UHFFFAOYSA-N
XLogP4.37
TPSA43.70 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.51
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [7-methoxy-1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone 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 [7-methoxy-1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone?
The IUPAC name of [7-methoxy-1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone (CID 71680724) is [7-methoxy-1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone.
What is the SMILES notation for [7-methoxy-1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone?
The canonical SMILES for [7-methoxy-1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone is COc1cccc2c(C(=O)c3cccc4ccccc34)cn(CCN3CCOCC3)c12.
What is the InChIKey of [7-methoxy-1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone?
The InChIKey is JBUVJMMEQOHCHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N2O3/c1-30-24-11-5-9-21-23(18-28(25(21)24)13-12-27-14-16-31-17-15-27)26(29)22-10-4-7-19-6-2-3-8-20(19)22/h2-11,18H,12-17H2,1H3.
What are the key properties of [7-methoxy-1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone?
[7-methoxy-1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone has a molecular weight of 414.51 g/mol, XLogP of 4.37, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [7-methoxy-1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone is sourced from PubChem (CID 71680724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).