N-cyclopropyl-4-methyl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfonamide

C20H22N2O3S — CID 42940847

IUPACN-cyclopropyl-4-methyl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)N1c2ccccc2CC1C
InChIInChI=1S/C20H22N2O3S/c1-13-7-10-17(26(24,25)21-16-8-9-16)12-18(13)20(23)22-14(2)11-15-5-3-4-6-19(15)22/h3-7,10,12,14,16,21H,8-9,11H2,1-2H3
InChIKeyYVAOLGCQEPSYNP-UHFFFAOYSA-N
MW370.47 g/mol
LogP3.03
Rot. Bonds4

About N-cyclopropyl-4-methyl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfonamide

N-cyclopropyl-4-methyl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfonamide (PubChem CID 42940847) has the molecular formula C20H22N2O3S and a molecular weight of 370.47 g/mol. Its IUPAC name is N-cyclopropyl-4-methyl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-4-methyl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfonamide
PubChem CID42940847
Molecular FormulaC20H22N2O3S
Molecular Weight370.47 g/mol
Exact Mass370.14
IUPAC NameN-cyclopropyl-4-methyl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)N1c2ccccc2CC1C
InChIInChI=1S/C20H22N2O3S/c1-13-7-10-17(26(24,25)21-16-8-9-16)12-18(13)20(23)22-14(2)11-15-5-3-4-6-19(15)22/h3-7,10,12,14,16,21H,8-9,11H2,1-2H3
InChIKeyYVAOLGCQEPSYNP-UHFFFAOYSA-N
XLogP3.03
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.47
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfonamide
CID 109063192
4-chloro-N-methyl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfonamide
CID 55524756
[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-(2-methyl-5-methylsulfonylphenyl)methanone
CID 95898234
2-chloro-N-cyclopropyl-5-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfonamide
CID 42892758
N-cyclopropyl-3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-4-methylbenzenesulfonamide
CID 35131778
N-[2-[(2R)-2-methyl-2,3-dihydroindole-1-carbonyl]phenyl]methanesulfonamide
CID 41368454
4-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-(2-methylpropyl)benzenesulfonamide
CID 109058986
5-(cyclopropylsulfamoyl)-N-[4-(2,3-dihydroindol-1-yl)phenyl]-2-methylbenzamide
CID 55731282
N-[4-chloro-3-[(2R)-2-methyl-2,3-dihydroindole-1-carbonyl]phenyl]benzenesulfonamide
CID 94012252
(5-amino-2-fluoro-3-methylphenyl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 103295777
N-cyclopropyl-4-methyl-3-[3-(methylamino)piperidine-1-carbonyl]benzenesulfonamide
CID 119490233
6-(cyclopropylsulfamoyl)-2-methyl-N-[(4-phenylphenyl)methyl]-2,3-dihydroindole-1-carboxamide
CID 142032480

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-methyl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfonamide?
The IUPAC name of N-cyclopropyl-4-methyl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfonamide (CID 42940847) is N-cyclopropyl-4-methyl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfonamide.
What is the SMILES notation for N-cyclopropyl-4-methyl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfonamide?
The canonical SMILES for N-cyclopropyl-4-methyl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfonamide is Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)N1c2ccccc2CC1C.
What is the InChIKey of N-cyclopropyl-4-methyl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfonamide?
The InChIKey is YVAOLGCQEPSYNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3S/c1-13-7-10-17(26(24,25)21-16-8-9-16)12-18(13)20(23)22-14(2)11-15-5-3-4-6-19(15)22/h3-7,10,12,14,16,21H,8-9,11H2,1-2H3.
What are the key properties of N-cyclopropyl-4-methyl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfonamide?
N-cyclopropyl-4-methyl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfonamide has a molecular weight of 370.47 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-methyl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfonamide is sourced from PubChem (CID 42940847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).