N-butyl-N-cyclopropyl-2,3-dihydro-1H-indole-5-sulfonamide

C15H22N2O2S — CID 61443459

IUPACN-butyl-N-cyclopropyl-2,3-dihydro-1H-indole-5-sulfonamide
SMILESCCCCN(C1CC1)S(=O)(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C15H22N2O2S/c1-2-3-10-17(13-4-5-13)20(18,19)14-6-7-15-12(11-14)8-9-16-15/h6-7,11,13,16H,2-5,8-10H2,1H3
InChIKeyDSSLMAHRZCHWQA-UHFFFAOYSA-N
MW294.42 g/mol
LogP2.61
Rot. Bonds6

About N-butyl-N-cyclopropyl-2,3-dihydro-1H-indole-5-sulfonamide

N-butyl-N-cyclopropyl-2,3-dihydro-1H-indole-5-sulfonamide (PubChem CID 61443459) has the molecular formula C15H22N2O2S and a molecular weight of 294.42 g/mol. Its IUPAC name is N-butyl-N-cyclopropyl-2,3-dihydro-1H-indole-5-sulfonamide.

Molecular Properties

Compound NameN-butyl-N-cyclopropyl-2,3-dihydro-1H-indole-5-sulfonamide
PubChem CID61443459
Molecular FormulaC15H22N2O2S
Molecular Weight294.42 g/mol
Exact Mass294.14
IUPAC NameN-butyl-N-cyclopropyl-2,3-dihydro-1H-indole-5-sulfonamide
SMILESCCCCN(C1CC1)S(=O)(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C15H22N2O2S/c1-2-3-10-17(13-4-5-13)20(18,19)14-6-7-15-12(11-14)8-9-16-15/h6-7,11,13,16H,2-5,8-10H2,1H3
InChIKeyDSSLMAHRZCHWQA-UHFFFAOYSA-N
XLogP2.61
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.42
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-butyl-N-cyclopropyl-2,3-dihydro-1H-isoindole-5-sulfonamide
CID 107421960
N-butyl-N-cyclopropyl-4-fluorobenzenesulfonamide
CID 60751133
N-cyclopentyl-N-methyl-2,3-dihydro-1H-indole-5-sulfonamide
CID 43267403
N-cycloheptyl-N-methyl-2,3-dihydro-1H-indole-5-sulfonamide
CID 43614367
3-amino-N-butyl-N-cyclopropyl-4-methylbenzenesulfonamide
CID 61112985
3-[butyl(cyclopropyl)sulfamoyl]benzenesulfonyl fluoride
CID 114791465
5-ethylsulfonyl-2,3-dihydro-1H-indole
CID 134176519
N-butyl-3-cyano-N-cyclopropyl-4-fluorobenzenesulfonamide
CID 63239480
N-methyl-N-propan-2-yl-2,3-dihydro-1H-indole-5-sulfonamide
CID 43119880
N-methyl-N-(oxolan-3-yl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 82742932
3-(aminomethyl)-N-butyl-N-cyclopropyl-4-fluorobenzenesulfonamide
CID 63288985
N-(5-hydroxypentyl)-N-methyl-2,3-dihydro-1H-indole-5-sulfonamide
CID 107200821

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-cyclopropyl-2,3-dihydro-1H-indole-5-sulfonamide?
The IUPAC name of N-butyl-N-cyclopropyl-2,3-dihydro-1H-indole-5-sulfonamide (CID 61443459) is N-butyl-N-cyclopropyl-2,3-dihydro-1H-indole-5-sulfonamide.
What is the SMILES notation for N-butyl-N-cyclopropyl-2,3-dihydro-1H-indole-5-sulfonamide?
The canonical SMILES for N-butyl-N-cyclopropyl-2,3-dihydro-1H-indole-5-sulfonamide is CCCCN(C1CC1)S(=O)(=O)c1ccc2c(c1)CCN2.
What is the InChIKey of N-butyl-N-cyclopropyl-2,3-dihydro-1H-indole-5-sulfonamide?
The InChIKey is DSSLMAHRZCHWQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2S/c1-2-3-10-17(13-4-5-13)20(18,19)14-6-7-15-12(11-14)8-9-16-15/h6-7,11,13,16H,2-5,8-10H2,1H3.
What are the key properties of N-butyl-N-cyclopropyl-2,3-dihydro-1H-indole-5-sulfonamide?
N-butyl-N-cyclopropyl-2,3-dihydro-1H-indole-5-sulfonamide has a molecular weight of 294.42 g/mol, XLogP of 2.61, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-cyclopropyl-2,3-dihydro-1H-indole-5-sulfonamide is sourced from PubChem (CID 61443459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).