N-[2-[(2R)-2-methyl-2,3-dihydroindole-1-carbonyl]phenyl]methanesulfonamide

C17H18N2O3S — CID 41368454

IUPACN-[2-[(2R)-2-methyl-2,3-dihydroindole-1-carbonyl]phenyl]methanesulfonamide
SMILESC[C@@H]1Cc2ccccc2N1C(=O)c1ccccc1NS(C)(=O)=O
InChIInChI=1S/C17H18N2O3S/c1-12-11-13-7-3-6-10-16(13)19(12)17(20)14-8-4-5-9-15(14)18-23(2,21)22/h3-10,12,18H,11H2,1-2H3/t12-/m1/s1
InChIKeyZXKPVZRJNOUTCI-GFCCVEGCSA-N
MW330.41 g/mol
LogP2.65
Rot. Bonds3

About N-[2-[(2R)-2-methyl-2,3-dihydroindole-1-carbonyl]phenyl]methanesulfonamide

N-[2-[(2R)-2-methyl-2,3-dihydroindole-1-carbonyl]phenyl]methanesulfonamide (PubChem CID 41368454) has the molecular formula C17H18N2O3S and a molecular weight of 330.41 g/mol. Its IUPAC name is N-[2-[(2R)-2-methyl-2,3-dihydroindole-1-carbonyl]phenyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-[(2R)-2-methyl-2,3-dihydroindole-1-carbonyl]phenyl]methanesulfonamide
PubChem CID41368454
Molecular FormulaC17H18N2O3S
Molecular Weight330.41 g/mol
Exact Mass330.10
IUPAC NameN-[2-[(2R)-2-methyl-2,3-dihydroindole-1-carbonyl]phenyl]methanesulfonamide
SMILESC[C@@H]1Cc2ccccc2N1C(=O)c1ccccc1NS(C)(=O)=O
InChIInChI=1S/C17H18N2O3S/c1-12-11-13-7-3-6-10-16(13)19(12)17(20)14-8-4-5-9-15(14)18-23(2,21)22/h3-10,12,18H,11H2,1-2H3/t12-/m1/s1
InChIKeyZXKPVZRJNOUTCI-GFCCVEGCSA-N
XLogP2.65
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.41
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-methyl-5-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-1,3-thiazol-2-yl]methanesulfonamide
CID 100772751
(2-methoxyphenyl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 19061805
(2-methyl-2,3-dihydroindol-1-yl)-phenylmethanone
CID 15274130
4-chloro-N-methyl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfonamide
CID 55524756
N-[4-chloro-3-[(2R)-2-methyl-2,3-dihydroindole-1-carbonyl]phenyl]benzenesulfonamide
CID 94012252
(2,5-dichlorophenyl)-[(2R)-2-methyl-2,3-dihydroindol-1-yl]methanone
CID 29176451
N-cyclopropyl-4-methyl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfonamide
CID 42940847
(2-chloro-5-hydroxyphenyl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 106501267
[(2S)-2-methyl-2,3-dihydroindol-1-yl]-(2-methylfuran-3-yl)methanone
CID 35523959
[(2R)-2-methyl-2,3-dihydroindol-1-yl]-[4-(methylsulfonylmethyl)phenyl]methanone
CID 26910884
[4-(methylamino)phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 62173307
(2,5-dimethylfuran-3-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 24655561

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2R)-2-methyl-2,3-dihydroindole-1-carbonyl]phenyl]methanesulfonamide?
The IUPAC name of N-[2-[(2R)-2-methyl-2,3-dihydroindole-1-carbonyl]phenyl]methanesulfonamide (CID 41368454) is N-[2-[(2R)-2-methyl-2,3-dihydroindole-1-carbonyl]phenyl]methanesulfonamide.
What is the SMILES notation for N-[2-[(2R)-2-methyl-2,3-dihydroindole-1-carbonyl]phenyl]methanesulfonamide?
The canonical SMILES for N-[2-[(2R)-2-methyl-2,3-dihydroindole-1-carbonyl]phenyl]methanesulfonamide is C[C@@H]1Cc2ccccc2N1C(=O)c1ccccc1NS(C)(=O)=O.
What is the InChIKey of N-[2-[(2R)-2-methyl-2,3-dihydroindole-1-carbonyl]phenyl]methanesulfonamide?
The InChIKey is ZXKPVZRJNOUTCI-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H18N2O3S/c1-12-11-13-7-3-6-10-16(13)19(12)17(20)14-8-4-5-9-15(14)18-23(2,21)22/h3-10,12,18H,11H2,1-2H3/t12-/m1/s1.
What are the key properties of N-[2-[(2R)-2-methyl-2,3-dihydroindole-1-carbonyl]phenyl]methanesulfonamide?
N-[2-[(2R)-2-methyl-2,3-dihydroindole-1-carbonyl]phenyl]methanesulfonamide has a molecular weight of 330.41 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2R)-2-methyl-2,3-dihydroindole-1-carbonyl]phenyl]methanesulfonamide is sourced from PubChem (CID 41368454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).