2-methyl-1-[(5-phenyl-1,3-oxazol-2-yl)methyl]-2,3-dihydroindole-5-sulfonamide

C19H19N3O3S — CID 42926233

IUPAC2-methyl-1-[(5-phenyl-1,3-oxazol-2-yl)methyl]-2,3-dihydroindole-5-sulfonamide
SMILESCC1Cc2cc(S(N)(=O)=O)ccc2N1Cc1ncc(-c2ccccc2)o1
InChIInChI=1S/C19H19N3O3S/c1-13-9-15-10-16(26(20,23)24)7-8-17(15)22(13)12-19-21-11-18(25-19)14-5-3-2-4-6-14/h2-8,10-11,13H,9,12H2,1H3,(H2,20,23,24)
InChIKeyGEAFQFIFFWDXPM-UHFFFAOYSA-N
MW369.45 g/mol
LogP2.94
Rot. Bonds4

About 2-methyl-1-[(5-phenyl-1,3-oxazol-2-yl)methyl]-2,3-dihydroindole-5-sulfonamide

2-methyl-1-[(5-phenyl-1,3-oxazol-2-yl)methyl]-2,3-dihydroindole-5-sulfonamide (PubChem CID 42926233) has the molecular formula C19H19N3O3S and a molecular weight of 369.45 g/mol. Its IUPAC name is 2-methyl-1-[(5-phenyl-1,3-oxazol-2-yl)methyl]-2,3-dihydroindole-5-sulfonamide.

Molecular Properties

Compound Name2-methyl-1-[(5-phenyl-1,3-oxazol-2-yl)methyl]-2,3-dihydroindole-5-sulfonamide
PubChem CID42926233
Molecular FormulaC19H19N3O3S
Molecular Weight369.45 g/mol
Exact Mass369.11
IUPAC Name2-methyl-1-[(5-phenyl-1,3-oxazol-2-yl)methyl]-2,3-dihydroindole-5-sulfonamide
SMILESCC1Cc2cc(S(N)(=O)=O)ccc2N1Cc1ncc(-c2ccccc2)o1
InChIInChI=1S/C19H19N3O3S/c1-13-9-15-10-16(26(20,23)24)7-8-17(15)22(13)12-19-21-11-18(25-19)14-5-3-2-4-6-14/h2-8,10-11,13H,9,12H2,1H3,(H2,20,23,24)
InChIKeyGEAFQFIFFWDXPM-UHFFFAOYSA-N
XLogP2.94
TPSA89.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.45
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[(5-phenyl-1,3-oxazol-2-yl)methyl]-2,3-dihydroindole-5-sulfonamide?
The IUPAC name of 2-methyl-1-[(5-phenyl-1,3-oxazol-2-yl)methyl]-2,3-dihydroindole-5-sulfonamide (CID 42926233) is 2-methyl-1-[(5-phenyl-1,3-oxazol-2-yl)methyl]-2,3-dihydroindole-5-sulfonamide.
What is the SMILES notation for 2-methyl-1-[(5-phenyl-1,3-oxazol-2-yl)methyl]-2,3-dihydroindole-5-sulfonamide?
The canonical SMILES for 2-methyl-1-[(5-phenyl-1,3-oxazol-2-yl)methyl]-2,3-dihydroindole-5-sulfonamide is CC1Cc2cc(S(N)(=O)=O)ccc2N1Cc1ncc(-c2ccccc2)o1.
What is the InChIKey of 2-methyl-1-[(5-phenyl-1,3-oxazol-2-yl)methyl]-2,3-dihydroindole-5-sulfonamide?
The InChIKey is GEAFQFIFFWDXPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3S/c1-13-9-15-10-16(26(20,23)24)7-8-17(15)22(13)12-19-21-11-18(25-19)14-5-3-2-4-6-14/h2-8,10-11,13H,9,12H2,1H3,(H2,20,23,24).
What are the key properties of 2-methyl-1-[(5-phenyl-1,3-oxazol-2-yl)methyl]-2,3-dihydroindole-5-sulfonamide?
2-methyl-1-[(5-phenyl-1,3-oxazol-2-yl)methyl]-2,3-dihydroindole-5-sulfonamide has a molecular weight of 369.45 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[(5-phenyl-1,3-oxazol-2-yl)methyl]-2,3-dihydroindole-5-sulfonamide is sourced from PubChem (CID 42926233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).