N-benzyl-N-methyl-2,3-dihydroindole-1-sulfonamide

C16H18N2O2S — CID 110865657

IUPACN-benzyl-N-methyl-2,3-dihydroindole-1-sulfonamide
SMILESCN(Cc1ccccc1)S(=O)(=O)N1CCc2ccccc21
InChIInChI=1S/C16H18N2O2S/c1-17(13-14-7-3-2-4-8-14)21(19,20)18-12-11-15-9-5-6-10-16(15)18/h2-10H,11-13H2,1H3
InChIKeyQQMPGWLJIYBMPM-UHFFFAOYSA-N
MW302.40 g/mol
LogP2.43
Rot. Bonds4

About N-benzyl-N-methyl-2,3-dihydroindole-1-sulfonamide

N-benzyl-N-methyl-2,3-dihydroindole-1-sulfonamide (PubChem CID 110865657) has the molecular formula C16H18N2O2S and a molecular weight of 302.40 g/mol. Its IUPAC name is N-benzyl-N-methyl-2,3-dihydroindole-1-sulfonamide.

Molecular Properties

Compound NameN-benzyl-N-methyl-2,3-dihydroindole-1-sulfonamide
PubChem CID110865657
Molecular FormulaC16H18N2O2S
Molecular Weight302.40 g/mol
Exact Mass302.11
IUPAC NameN-benzyl-N-methyl-2,3-dihydroindole-1-sulfonamide
SMILESCN(Cc1ccccc1)S(=O)(=O)N1CCc2ccccc21
InChIInChI=1S/C16H18N2O2S/c1-17(13-14-7-3-2-4-8-14)21(19,20)18-12-11-15-9-5-6-10-16(15)18/h2-10H,11-13H2,1H3
InChIKeyQQMPGWLJIYBMPM-UHFFFAOYSA-N
XLogP2.43
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.40
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-1-(3,4-dihydro-2H-quinolin-1-yl)-N-methylmethanesulfonamide
CID 175129853
N-benzyl-N-(2,3-dihydroindol-1-yl)methanesulfonamide
CID 91216007
N,N-dibenzyl-4-(2,3-dihydroindol-1-ylsulfonyl)benzamide
CID 4128008
N-benzyl-3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-N-methylpropanamide
CID 110342828
N-benzyl-5-(2,3-dihydroindole-1-carbonyl)-2-methoxy-N-methylbenzenesulfonamide
CID 26290496
N-methyl-N-(pyridin-4-ylmethyl)-3,4-dihydro-1H-isoquinoline-2-sulfonamide
CID 53499305
N-methyl-N-(methylsulfonimidoyl)-1-phenylmethanamine
CID 148954390
4-[5-[benzyl(methyl)sulfamoyl]-2,3-dihydroindol-1-yl]-4-oxobutanoic acid
CID 6619736
N-benzyl-N-phenyl-2,3-dihydroindole-1-carboxamide
CID 108991209
1-pyrrolidin-1-ylsulfonyl-2,3-dihydroindole
CID 110705798
N-benzyl-N-propan-2-yl-3,4-dihydro-2H-quinoline-1-carboxamide
CID 108990709
ethyl 2-[2,3-dihydroindol-1-ylsulfonyl-[(3-phenylmethoxyphenyl)methyl]amino]acetate
CID 69362996

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-2,3-dihydroindole-1-sulfonamide?
The IUPAC name of N-benzyl-N-methyl-2,3-dihydroindole-1-sulfonamide (CID 110865657) is N-benzyl-N-methyl-2,3-dihydroindole-1-sulfonamide.
What is the SMILES notation for N-benzyl-N-methyl-2,3-dihydroindole-1-sulfonamide?
The canonical SMILES for N-benzyl-N-methyl-2,3-dihydroindole-1-sulfonamide is CN(Cc1ccccc1)S(=O)(=O)N1CCc2ccccc21.
What is the InChIKey of N-benzyl-N-methyl-2,3-dihydroindole-1-sulfonamide?
The InChIKey is QQMPGWLJIYBMPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2S/c1-17(13-14-7-3-2-4-8-14)21(19,20)18-12-11-15-9-5-6-10-16(15)18/h2-10H,11-13H2,1H3.
What are the key properties of N-benzyl-N-methyl-2,3-dihydroindole-1-sulfonamide?
N-benzyl-N-methyl-2,3-dihydroindole-1-sulfonamide has a molecular weight of 302.40 g/mol, XLogP of 2.43, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-2,3-dihydroindole-1-sulfonamide is sourced from PubChem (CID 110865657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).