N-(2,5-dimethoxyphenyl)-5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carboxamide

C28H29N3O5 — CID 46259620

IUPACN-(2,5-dimethoxyphenyl)-5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)N2CCc3cc(-c4ccc(C(=O)N5CCOCC5)cc4)ccc32)c1
InChIInChI=1S/C28H29N3O5/c1-34-23-8-10-26(35-2)24(18-23)29-28(33)31-12-11-22-17-21(7-9-25(22)31)19-3-5-20(6-4-19)27(32)30-13-15-36-16-14-30/h3-10,17-18H,11-16H2,1-2H3,(H,29,33)
InChIKeyUUVJUOUMZRMBTL-UHFFFAOYSA-N
MW487.56 g/mol
LogP4.44
Rot. Bonds5

About N-(2,5-dimethoxyphenyl)-5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carboxamide

N-(2,5-dimethoxyphenyl)-5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carboxamide (PubChem CID 46259620) has the molecular formula C28H29N3O5 and a molecular weight of 487.56 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carboxamide
PubChem CID46259620
Molecular FormulaC28H29N3O5
Molecular Weight487.56 g/mol
Exact Mass487.21
IUPAC NameN-(2,5-dimethoxyphenyl)-5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)N2CCc3cc(-c4ccc(C(=O)N5CCOCC5)cc4)ccc32)c1
InChIInChI=1S/C28H29N3O5/c1-34-23-8-10-26(35-2)24(18-23)29-28(33)31-12-11-22-17-21(7-9-25(22)31)19-3-5-20(6-4-19)27(32)30-13-15-36-16-14-30/h3-10,17-18H,11-16H2,1-2H3,(H,29,33)
InChIKeyUUVJUOUMZRMBTL-UHFFFAOYSA-N
XLogP4.44
TPSA80.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500487.56
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(2,5-dimethoxyphenyl)-5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carboxamide 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

ethyl 4-[[5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carbonyl]amino]benzoate
CID 46383956
N-(2-methylpropyl)-5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carboxamide
CID 46383985
2-methyl-1-[5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindol-1-yl]propan-1-one
CID 53109904
ethyl 2-[[5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carbonyl]amino]acetate
CID 46383962
N-(3-methylbutyl)-5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carboxamide
CID 46383982
ethyl (2R)-2-[[5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carbonyl]amino]propanoate
CID 92882080
[4-(4-methoxyphenyl)phenyl]-morpholin-4-ylmethanone
CID 3530238
1-[5-[4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phenyl]-2,3-dihydroindol-1-yl]ethanone
CID 53109962
N-[2-methoxy-5-(morpholine-4-carbonyl)phenyl]propanamide
CID 50875914
5-(4-cyclohexylphenyl)-N-(2-methoxyphenyl)-2,3-dihydroindole-1-carboxamide
CID 70854071
N-(2,5-dimethoxyphenyl)-4-(furan-3-carbonyl)-1,4-diazepane-1-carboxamide
CID 72912569
(3,4-dimethoxyphenyl)-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)methanone
CID 4600615

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carboxamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carboxamide (CID 46259620) is N-(2,5-dimethoxyphenyl)-5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carboxamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carboxamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carboxamide is COc1ccc(OC)c(NC(=O)N2CCc3cc(-c4ccc(C(=O)N5CCOCC5)cc4)ccc32)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carboxamide?
The InChIKey is UUVJUOUMZRMBTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H29N3O5/c1-34-23-8-10-26(35-2)24(18-23)29-28(33)31-12-11-22-17-21(7-9-25(22)31)19-3-5-20(6-4-19)27(32)30-13-15-36-16-14-30/h3-10,17-18H,11-16H2,1-2H3,(H,29,33).
What are the key properties of N-(2,5-dimethoxyphenyl)-5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carboxamide?
N-(2,5-dimethoxyphenyl)-5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carboxamide has a molecular weight of 487.56 g/mol, XLogP of 4.44, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-5-[4-(morpholine-4-carbonyl)phenyl]-2,3-dihydroindole-1-carboxamide is sourced from PubChem (CID 46259620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).