[4-(2,3-dihydro-1H-indol-3-ylsulfonyl)phenyl]-morpholin-4-ylmethanone

C19H20N2O4S — CID 69428960

IUPAC[4-(2,3-dihydro-1H-indol-3-ylsulfonyl)phenyl]-morpholin-4-ylmethanone
SMILESO=C(c1ccc(S(=O)(=O)C2CNc3ccccc32)cc1)N1CCOCC1
InChIInChI=1S/C19H20N2O4S/c22-19(21-9-11-25-12-10-21)14-5-7-15(8-6-14)26(23,24)18-13-20-17-4-2-1-3-16(17)18/h1-8,18,20H,9-13H2
InChIKeyUZXLPVPECLJQOJ-UHFFFAOYSA-N
MW372.45 g/mol
LogP2.10
Rot. Bonds3

About [4-(2,3-dihydro-1H-indol-3-ylsulfonyl)phenyl]-morpholin-4-ylmethanone

[4-(2,3-dihydro-1H-indol-3-ylsulfonyl)phenyl]-morpholin-4-ylmethanone (PubChem CID 69428960) has the molecular formula C19H20N2O4S and a molecular weight of 372.45 g/mol. Its IUPAC name is [4-(2,3-dihydro-1H-indol-3-ylsulfonyl)phenyl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[4-(2,3-dihydro-1H-indol-3-ylsulfonyl)phenyl]-morpholin-4-ylmethanone
PubChem CID69428960
Molecular FormulaC19H20N2O4S
Molecular Weight372.45 g/mol
Exact Mass372.11
IUPAC Name[4-(2,3-dihydro-1H-indol-3-ylsulfonyl)phenyl]-morpholin-4-ylmethanone
SMILESO=C(c1ccc(S(=O)(=O)C2CNc3ccccc32)cc1)N1CCOCC1
InChIInChI=1S/C19H20N2O4S/c22-19(21-9-11-25-12-10-21)14-5-7-15(8-6-14)26(23,24)18-13-20-17-4-2-1-3-16(17)18/h1-8,18,20H,9-13H2
InChIKeyUZXLPVPECLJQOJ-UHFFFAOYSA-N
XLogP2.10
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.45
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [4-(2,3-dihydro-1H-indol-3-ylsulfonyl)phenyl]-morpholin-4-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 [4-(2,3-dihydro-1H-indol-3-ylsulfonyl)phenyl]-morpholin-4-ylmethanone?
The IUPAC name of [4-(2,3-dihydro-1H-indol-3-ylsulfonyl)phenyl]-morpholin-4-ylmethanone (CID 69428960) is [4-(2,3-dihydro-1H-indol-3-ylsulfonyl)phenyl]-morpholin-4-ylmethanone.
What is the SMILES notation for [4-(2,3-dihydro-1H-indol-3-ylsulfonyl)phenyl]-morpholin-4-ylmethanone?
The canonical SMILES for [4-(2,3-dihydro-1H-indol-3-ylsulfonyl)phenyl]-morpholin-4-ylmethanone is O=C(c1ccc(S(=O)(=O)C2CNc3ccccc32)cc1)N1CCOCC1.
What is the InChIKey of [4-(2,3-dihydro-1H-indol-3-ylsulfonyl)phenyl]-morpholin-4-ylmethanone?
The InChIKey is UZXLPVPECLJQOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4S/c22-19(21-9-11-25-12-10-21)14-5-7-15(8-6-14)26(23,24)18-13-20-17-4-2-1-3-16(17)18/h1-8,18,20H,9-13H2.
What are the key properties of [4-(2,3-dihydro-1H-indol-3-ylsulfonyl)phenyl]-morpholin-4-ylmethanone?
[4-(2,3-dihydro-1H-indol-3-ylsulfonyl)phenyl]-morpholin-4-ylmethanone has a molecular weight of 372.45 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,3-dihydro-1H-indol-3-ylsulfonyl)phenyl]-morpholin-4-ylmethanone is sourced from PubChem (CID 69428960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).