N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetamide

C20H25N3O4S — CID 7987425

IUPACN-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetamide
SMILESCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)CN1c2ccccc2C[C@@H]1C
InChIInChI=1S/C20H25N3O4S/c1-14-11-15-7-5-6-8-18(15)23(14)13-20(24)21-17-12-16(9-10-19(17)27-4)28(25,26)22(2)3/h5-10,12,14H,11,13H2,1-4H3,(H,21,24)/t14-/m0/s1
InChIKeyNQGOWMGUQOSYEG-AWEZNQCLSA-N
MW403.50 g/mol
LogP2.34
Rot. Bonds6

About N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetamide

N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetamide (PubChem CID 7987425) has the molecular formula C20H25N3O4S and a molecular weight of 403.50 g/mol. Its IUPAC name is N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetamide.

Molecular Properties

Compound NameN-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetamide
PubChem CID7987425
Molecular FormulaC20H25N3O4S
Molecular Weight403.50 g/mol
Exact Mass403.16
IUPAC NameN-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetamide
SMILESCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)CN1c2ccccc2C[C@@H]1C
InChIInChI=1S/C20H25N3O4S/c1-14-11-15-7-5-6-8-18(15)23(14)13-20(24)21-17-12-16(9-10-19(17)27-4)28(25,26)22(2)3/h5-10,12,14H,11,13H2,1-4H3,(H,21,24)/t14-/m0/s1
InChIKeyNQGOWMGUQOSYEG-AWEZNQCLSA-N
XLogP2.34
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.50
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-chloro-2-methoxyphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide
CID 3302526
N-(5-chloro-2-methoxyphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide
CID 7940760
N-(2-methoxyphenyl)-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetamide
CID 25346939
N-[4-(dimethylsulfamoyl)phenyl]-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide
CID 2484554
N-[4-(dimethylsulfamoyl)phenyl]-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide
CID 3289813
N-[3-(dimethylsulfamoyl)phenyl]-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide
CID 51159788
4-methoxy-N,N-dimethyl-3-[3-(2-methyl-2,3-dihydroindol-1-yl)-3-oxopropyl]benzenesulfonamide
CID 133178573
N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-3,3-diphenylpropanamide
CID 26205505
N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetamide
CID 41101632
N-(4-chloro-2,5-dimethoxyphenyl)-2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)acetamide
CID 24566730
N-[3-(dimethylsulfamoyl)phenyl]-2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]acetamide
CID 8724718
N-(2-fluorophenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide
CID 2652898

Frequently Asked Questions

What is the IUPAC name of N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetamide?
The IUPAC name of N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetamide (CID 7987425) is N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetamide.
What is the SMILES notation for N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetamide?
The canonical SMILES for N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetamide is COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)CN1c2ccccc2C[C@@H]1C.
What is the InChIKey of N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetamide?
The InChIKey is NQGOWMGUQOSYEG-AWEZNQCLSA-N. The full InChI is InChI=1S/C20H25N3O4S/c1-14-11-15-7-5-6-8-18(15)23(14)13-20(24)21-17-12-16(9-10-19(17)27-4)28(25,26)22(2)3/h5-10,12,14H,11,13H2,1-4H3,(H,21,24)/t14-/m0/s1.
What are the key properties of N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetamide?
N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetamide has a molecular weight of 403.50 g/mol, XLogP of 2.34, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetamide is sourced from PubChem (CID 7987425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).