N-(2-ethylcyclopropyl)-2,3-dihydro-1H-indole-5-sulfonamide

C13H18N2O2S — CID 114108612

IUPACN-(2-ethylcyclopropyl)-2,3-dihydro-1H-indole-5-sulfonamide
SMILESCCC1CC1NS(=O)(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C13H18N2O2S/c1-2-9-8-13(9)15-18(16,17)11-3-4-12-10(7-11)5-6-14-12/h3-4,7,9,13-15H,2,5-6,8H2,1H3
InChIKeyXDONPXOMHQTZQR-UHFFFAOYSA-N
MW266.37 g/mol
LogP1.73
Rot. Bonds4

About N-(2-ethylcyclopropyl)-2,3-dihydro-1H-indole-5-sulfonamide

N-(2-ethylcyclopropyl)-2,3-dihydro-1H-indole-5-sulfonamide (PubChem CID 114108612) has the molecular formula C13H18N2O2S and a molecular weight of 266.37 g/mol. Its IUPAC name is N-(2-ethylcyclopropyl)-2,3-dihydro-1H-indole-5-sulfonamide.

Molecular Properties

Compound NameN-(2-ethylcyclopropyl)-2,3-dihydro-1H-indole-5-sulfonamide
PubChem CID114108612
Molecular FormulaC13H18N2O2S
Molecular Weight266.37 g/mol
Exact Mass266.11
IUPAC NameN-(2-ethylcyclopropyl)-2,3-dihydro-1H-indole-5-sulfonamide
SMILESCCC1CC1NS(=O)(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C13H18N2O2S/c1-2-9-8-13(9)15-18(16,17)11-3-4-12-10(7-11)5-6-14-12/h3-4,7,9,13-15H,2,5-6,8H2,1H3
InChIKeyXDONPXOMHQTZQR-UHFFFAOYSA-N
XLogP1.73
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.37
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methylcyclohexyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 43119924
N-(3-methylcyclopentyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 114548153
5-ethylsulfonyl-2,3-dihydro-1H-indole
CID 134176519
N-(4-hydroxycyclohexyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 28940832
N-(2-methylbutyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 62693554
N-(2,2-dimethylcyclopentyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 79878268
N-[(3-methylcyclopentyl)methyl]-2,3-dihydro-1H-indole-5-sulfonamide
CID 107414189
4-amino-3-chloro-N-(2-ethylcyclopropyl)benzenesulfonamide
CID 114108611
N-(3-methylbut-2-enyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 106191065
N-(1-methylpiperidin-3-yl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 61222738
N-(3-ethylpentan-3-yl)-1,2,3,4-tetrahydroquinoline-6-sulfonamide
CID 65042936
N-(2-bromo-5-fluorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 107626863

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylcyclopropyl)-2,3-dihydro-1H-indole-5-sulfonamide?
The IUPAC name of N-(2-ethylcyclopropyl)-2,3-dihydro-1H-indole-5-sulfonamide (CID 114108612) is N-(2-ethylcyclopropyl)-2,3-dihydro-1H-indole-5-sulfonamide.
What is the SMILES notation for N-(2-ethylcyclopropyl)-2,3-dihydro-1H-indole-5-sulfonamide?
The canonical SMILES for N-(2-ethylcyclopropyl)-2,3-dihydro-1H-indole-5-sulfonamide is CCC1CC1NS(=O)(=O)c1ccc2c(c1)CCN2.
What is the InChIKey of N-(2-ethylcyclopropyl)-2,3-dihydro-1H-indole-5-sulfonamide?
The InChIKey is XDONPXOMHQTZQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2S/c1-2-9-8-13(9)15-18(16,17)11-3-4-12-10(7-11)5-6-14-12/h3-4,7,9,13-15H,2,5-6,8H2,1H3.
What are the key properties of N-(2-ethylcyclopropyl)-2,3-dihydro-1H-indole-5-sulfonamide?
N-(2-ethylcyclopropyl)-2,3-dihydro-1H-indole-5-sulfonamide has a molecular weight of 266.37 g/mol, XLogP of 1.73, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylcyclopropyl)-2,3-dihydro-1H-indole-5-sulfonamide is sourced from PubChem (CID 114108612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).