1-(1-aminocyclopentanecarbonyl)-N,N-dimethyl-2,3-dihydroindole-6-sulfonamide;hydrochloride

C16H24ClN3O3S — CID 119324921

IUPAC1-(1-aminocyclopentanecarbonyl)-N,N-dimethyl-2,3-dihydroindole-6-sulfonamide;hydrochloride
SMILESCN(C)S(=O)(=O)c1ccc2c(c1)N(C(=O)C1(N)CCCC1)CC2.Cl
InChIInChI=1S/C16H23N3O3S.ClH/c1-18(2)23(21,22)13-6-5-12-7-10-19(14(12)11-13)15(20)16(17)8-3-4-9-16;/h5-6,11H,3-4,7-10,17H2,1-2H3;1H
InChIKeyLFRHMOOTALDNEE-UHFFFAOYSA-N
MW373.91 g/mol
LogP1.52
Rot. Bonds3

About 1-(1-aminocyclopentanecarbonyl)-N,N-dimethyl-2,3-dihydroindole-6-sulfonamide;hydrochloride

1-(1-aminocyclopentanecarbonyl)-N,N-dimethyl-2,3-dihydroindole-6-sulfonamide;hydrochloride (PubChem CID 119324921) has the molecular formula C16H24ClN3O3S and a molecular weight of 373.91 g/mol. Its IUPAC name is 1-(1-aminocyclopentanecarbonyl)-N,N-dimethyl-2,3-dihydroindole-6-sulfonamide;hydrochloride.

Molecular Properties

Compound Name1-(1-aminocyclopentanecarbonyl)-N,N-dimethyl-2,3-dihydroindole-6-sulfonamide;hydrochloride
PubChem CID119324921
Molecular FormulaC16H24ClN3O3S
Molecular Weight373.91 g/mol
Exact Mass373.12
IUPAC Name1-(1-aminocyclopentanecarbonyl)-N,N-dimethyl-2,3-dihydroindole-6-sulfonamide;hydrochloride
SMILESCN(C)S(=O)(=O)c1ccc2c(c1)N(C(=O)C1(N)CCCC1)CC2.Cl
InChIInChI=1S/C16H23N3O3S.ClH/c1-18(2)23(21,22)13-6-5-12-7-10-19(14(12)11-13)15(20)16(17)8-3-4-9-16;/h5-6,11H,3-4,7-10,17H2,1-2H3;1H
InChIKeyLFRHMOOTALDNEE-UHFFFAOYSA-N
XLogP1.52
TPSA83.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.91
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(1-aminocyclopentanecarbonyl)-N,N-dimethyl-2,3-dihydroindole-6-sulfonamide;hydrochloride?
The IUPAC name of 1-(1-aminocyclopentanecarbonyl)-N,N-dimethyl-2,3-dihydroindole-6-sulfonamide;hydrochloride (CID 119324921) is 1-(1-aminocyclopentanecarbonyl)-N,N-dimethyl-2,3-dihydroindole-6-sulfonamide;hydrochloride.
What is the SMILES notation for 1-(1-aminocyclopentanecarbonyl)-N,N-dimethyl-2,3-dihydroindole-6-sulfonamide;hydrochloride?
The canonical SMILES for 1-(1-aminocyclopentanecarbonyl)-N,N-dimethyl-2,3-dihydroindole-6-sulfonamide;hydrochloride is CN(C)S(=O)(=O)c1ccc2c(c1)N(C(=O)C1(N)CCCC1)CC2.Cl.
What is the InChIKey of 1-(1-aminocyclopentanecarbonyl)-N,N-dimethyl-2,3-dihydroindole-6-sulfonamide;hydrochloride?
The InChIKey is LFRHMOOTALDNEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O3S.ClH/c1-18(2)23(21,22)13-6-5-12-7-10-19(14(12)11-13)15(20)16(17)8-3-4-9-16;/h5-6,11H,3-4,7-10,17H2,1-2H3;1H.
What are the key properties of 1-(1-aminocyclopentanecarbonyl)-N,N-dimethyl-2,3-dihydroindole-6-sulfonamide;hydrochloride?
1-(1-aminocyclopentanecarbonyl)-N,N-dimethyl-2,3-dihydroindole-6-sulfonamide;hydrochloride has a molecular weight of 373.91 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-aminocyclopentanecarbonyl)-N,N-dimethyl-2,3-dihydroindole-6-sulfonamide;hydrochloride is sourced from PubChem (CID 119324921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).