N-cyclopropyl-5-[1-(methylamino)ethyl]-2,3-dihydroindole-1-sulfonamide

C14H21N3O2S — CID 102661361

IUPACN-cyclopropyl-5-[1-(methylamino)ethyl]-2,3-dihydroindole-1-sulfonamide
SMILESCNC(C)c1ccc2c(c1)CCN2S(=O)(=O)NC1CC1
InChIInChI=1S/C14H21N3O2S/c1-10(15-2)11-3-6-14-12(9-11)7-8-17(14)20(18,19)16-13-4-5-13/h3,6,9-10,13,15-16H,4-5,7-8H2,1-2H3
InChIKeyYINTXSJJGJAXJV-UHFFFAOYSA-N
MW295.41 g/mol
LogP1.33
Rot. Bonds5

About N-cyclopropyl-5-[1-(methylamino)ethyl]-2,3-dihydroindole-1-sulfonamide

N-cyclopropyl-5-[1-(methylamino)ethyl]-2,3-dihydroindole-1-sulfonamide (PubChem CID 102661361) has the molecular formula C14H21N3O2S and a molecular weight of 295.41 g/mol. Its IUPAC name is N-cyclopropyl-5-[1-(methylamino)ethyl]-2,3-dihydroindole-1-sulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-5-[1-(methylamino)ethyl]-2,3-dihydroindole-1-sulfonamide
PubChem CID102661361
Molecular FormulaC14H21N3O2S
Molecular Weight295.41 g/mol
Exact Mass295.14
IUPAC NameN-cyclopropyl-5-[1-(methylamino)ethyl]-2,3-dihydroindole-1-sulfonamide
SMILESCNC(C)c1ccc2c(c1)CCN2S(=O)(=O)NC1CC1
InChIInChI=1S/C14H21N3O2S/c1-10(15-2)11-3-6-14-12(9-11)7-8-17(14)20(18,19)16-13-4-5-13/h3,6,9-10,13,15-16H,4-5,7-8H2,1-2H3
InChIKeyYINTXSJJGJAXJV-UHFFFAOYSA-N
XLogP1.33
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.41
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-5-[1-(methylamino)ethyl]-2,3-dihydroindole-1-sulfonamide
CID 102661359
5-(1-aminoethyl)-N-propan-2-yl-2,3-dihydroindole-1-sulfonamide
CID 102661293
5-[1-(ethylamino)ethyl]-N-propyl-2,3-dihydroindole-1-sulfonamide
CID 102661387
1-(1-cyclohexylsulfonyl-2,3-dihydroindol-5-yl)ethanamine
CID 102661303
N,N-dimethyl-2-[5-[1-(methylamino)ethyl]-2,3-dihydroindol-1-yl]acetamide
CID 102661662
1-methyl-6-[1-(methylamino)ethyl]-3,4-dihydroquinolin-2-one
CID 63105201
N-cyclopropyl-N-methyl-2-[5-[1-(methylamino)ethyl]-2,3-dihydroindol-1-yl]acetamide
CID 102661728
N-methyl-1-[1-(2-methylsulfonylethyl)-3,4-dihydro-2H-quinolin-6-yl]ethanamine
CID 102661997
N-methyl-2-[5-[1-(methylamino)ethyl]-2,3-dihydroindol-1-yl]acetamide
CID 102661706
1-[1-(2-ethylbutyl)-2,3-dihydroindol-5-yl]-N-methylethanamine
CID 102661621
N-methyl-1-[1-(2,2,2-trifluoroethyl)-2,3-dihydroindol-5-yl]ethanamine
CID 102661702
2-[1-(benzenesulfonyl)-2,3-dihydroindol-5-yl]propanal
CID 174519680

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-[1-(methylamino)ethyl]-2,3-dihydroindole-1-sulfonamide?
The IUPAC name of N-cyclopropyl-5-[1-(methylamino)ethyl]-2,3-dihydroindole-1-sulfonamide (CID 102661361) is N-cyclopropyl-5-[1-(methylamino)ethyl]-2,3-dihydroindole-1-sulfonamide.
What is the SMILES notation for N-cyclopropyl-5-[1-(methylamino)ethyl]-2,3-dihydroindole-1-sulfonamide?
The canonical SMILES for N-cyclopropyl-5-[1-(methylamino)ethyl]-2,3-dihydroindole-1-sulfonamide is CNC(C)c1ccc2c(c1)CCN2S(=O)(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-5-[1-(methylamino)ethyl]-2,3-dihydroindole-1-sulfonamide?
The InChIKey is YINTXSJJGJAXJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2S/c1-10(15-2)11-3-6-14-12(9-11)7-8-17(14)20(18,19)16-13-4-5-13/h3,6,9-10,13,15-16H,4-5,7-8H2,1-2H3.
What are the key properties of N-cyclopropyl-5-[1-(methylamino)ethyl]-2,3-dihydroindole-1-sulfonamide?
N-cyclopropyl-5-[1-(methylamino)ethyl]-2,3-dihydroindole-1-sulfonamide has a molecular weight of 295.41 g/mol, XLogP of 1.33, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-[1-(methylamino)ethyl]-2,3-dihydroindole-1-sulfonamide is sourced from PubChem (CID 102661361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).