N-[2-[(3S)-5-methoxy-2-oxo-1,3-dihydroindol-3-yl]ethyl]-4-methyl-3-morpholin-4-ylbenzamide

C23H27N3O4 — CID 92627067

IUPACN-[2-[(3S)-5-methoxy-2-oxo-1,3-dihydroindol-3-yl]ethyl]-4-methyl-3-morpholin-4-ylbenzamide
SMILESCOc1ccc2c(c1)[C@H](CCNC(=O)c1ccc(C)c(N3CCOCC3)c1)C(=O)N2
InChIInChI=1S/C23H27N3O4/c1-15-3-4-16(13-21(15)26-9-11-30-12-10-26)22(27)24-8-7-18-19-14-17(29-2)5-6-20(19)25-23(18)28/h3-6,13-14,18H,7-12H2,1-2H3,(H,24,27)(H,25,28)/t18-/m0/s1
InChIKeyXAWKUHVHZBJRIQ-SFHVURJKSA-N
MW409.49 g/mol
LogP2.70
Rot. Bonds6

About N-[2-[(3S)-5-methoxy-2-oxo-1,3-dihydroindol-3-yl]ethyl]-4-methyl-3-morpholin-4-ylbenzamide

N-[2-[(3S)-5-methoxy-2-oxo-1,3-dihydroindol-3-yl]ethyl]-4-methyl-3-morpholin-4-ylbenzamide (PubChem CID 92627067) has the molecular formula C23H27N3O4 and a molecular weight of 409.49 g/mol. Its IUPAC name is N-[2-[(3S)-5-methoxy-2-oxo-1,3-dihydroindol-3-yl]ethyl]-4-methyl-3-morpholin-4-ylbenzamide.

Molecular Properties

Compound NameN-[2-[(3S)-5-methoxy-2-oxo-1,3-dihydroindol-3-yl]ethyl]-4-methyl-3-morpholin-4-ylbenzamide
PubChem CID92627067
Molecular FormulaC23H27N3O4
Molecular Weight409.49 g/mol
Exact Mass409.20
IUPAC NameN-[2-[(3S)-5-methoxy-2-oxo-1,3-dihydroindol-3-yl]ethyl]-4-methyl-3-morpholin-4-ylbenzamide
SMILESCOc1ccc2c(c1)[C@H](CCNC(=O)c1ccc(C)c(N3CCOCC3)c1)C(=O)N2
InChIInChI=1S/C23H27N3O4/c1-15-3-4-16(13-21(15)26-9-11-30-12-10-26)22(27)24-8-7-18-19-14-17(29-2)5-6-20(19)25-23(18)28/h3-6,13-14,18H,7-12H2,1-2H3,(H,24,27)(H,25,28)/t18-/m0/s1
InChIKeyXAWKUHVHZBJRIQ-SFHVURJKSA-N
XLogP2.70
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.49
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[2-[(3S)-5-methoxy-2-oxo-1,3-dihydroindol-3-yl]ethyl]-4-methyl-3-morpholin-4-ylbenzamide 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-(3,5-dimethylpyrazol-1-yl)-N-[2-[(3R)-5-methoxy-2-oxo-1,3-dihydroindol-3-yl]ethyl]benzamide
CID 98139514
3,5-dimethoxy-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide
CID 110730193
4-methoxy-3-morpholin-4-yl-N-[4-(oxolan-2-yl)butyl]benzamide
CID 135104850
N-(5-methoxy-2-morpholin-4-ylphenyl)-3,4-dimethylbenzamide
CID 17027218
N-[2-(4-methoxyphenoxy)ethyl]-4-methyl-3-morpholin-4-ylsulfonylbenzamide
CID 27173584
N-[2-(5-methoxy-2-oxo-1,3-dihydroindol-3-yl)ethyl]-2-[6-(4-methoxyphenyl)furo[2,3-f][1,3]benzodioxol-7-yl]acetamide
CID 155486684
4-methyl-3-morpholin-4-yl-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide
CID 46977362
4-methyl-N-[(6-methyl-2-pyridinyl)methyl]-3-morpholin-4-ylbenzamide
CID 138031186
4-methyl-N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]-3-pyrrolidin-1-ylbenzamide
CID 92626833
3-methoxy-N-[2-(4-phenylmorpholin-2-yl)ethyl]benzamide
CID 110709827
N-[2-(2,5-dioxoimidazolidin-4-yl)ethyl]-3-methoxybenzamide
CID 110722120
N-[(6-methoxynaphthalen-2-yl)methyl]-4-morpholin-4-yl-3-nitrobenzamide
CID 16962073

Frequently Asked Questions

What is the IUPAC name of N-[2-[(3S)-5-methoxy-2-oxo-1,3-dihydroindol-3-yl]ethyl]-4-methyl-3-morpholin-4-ylbenzamide?
The IUPAC name of N-[2-[(3S)-5-methoxy-2-oxo-1,3-dihydroindol-3-yl]ethyl]-4-methyl-3-morpholin-4-ylbenzamide (CID 92627067) is N-[2-[(3S)-5-methoxy-2-oxo-1,3-dihydroindol-3-yl]ethyl]-4-methyl-3-morpholin-4-ylbenzamide.
What is the SMILES notation for N-[2-[(3S)-5-methoxy-2-oxo-1,3-dihydroindol-3-yl]ethyl]-4-methyl-3-morpholin-4-ylbenzamide?
The canonical SMILES for N-[2-[(3S)-5-methoxy-2-oxo-1,3-dihydroindol-3-yl]ethyl]-4-methyl-3-morpholin-4-ylbenzamide is COc1ccc2c(c1)[C@H](CCNC(=O)c1ccc(C)c(N3CCOCC3)c1)C(=O)N2.
What is the InChIKey of N-[2-[(3S)-5-methoxy-2-oxo-1,3-dihydroindol-3-yl]ethyl]-4-methyl-3-morpholin-4-ylbenzamide?
The InChIKey is XAWKUHVHZBJRIQ-SFHVURJKSA-N. The full InChI is InChI=1S/C23H27N3O4/c1-15-3-4-16(13-21(15)26-9-11-30-12-10-26)22(27)24-8-7-18-19-14-17(29-2)5-6-20(19)25-23(18)28/h3-6,13-14,18H,7-12H2,1-2H3,(H,24,27)(H,25,28)/t18-/m0/s1.
What are the key properties of N-[2-[(3S)-5-methoxy-2-oxo-1,3-dihydroindol-3-yl]ethyl]-4-methyl-3-morpholin-4-ylbenzamide?
N-[2-[(3S)-5-methoxy-2-oxo-1,3-dihydroindol-3-yl]ethyl]-4-methyl-3-morpholin-4-ylbenzamide has a molecular weight of 409.49 g/mol, XLogP of 2.70, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(3S)-5-methoxy-2-oxo-1,3-dihydroindol-3-yl]ethyl]-4-methyl-3-morpholin-4-ylbenzamide is sourced from PubChem (CID 92627067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).