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

C15H22ClN3O4S — CID 119785866

IUPACN,N-dimethyl-1-(morpholine-3-carbonyl)-2,3-dihydroindole-6-sulfonamide;hydrochloride
SMILESCN(C)S(=O)(=O)c1ccc2c(c1)N(C(=O)C1COCCN1)CC2.Cl
InChIInChI=1S/C15H21N3O4S.ClH/c1-17(2)23(20,21)12-4-3-11-5-7-18(14(11)9-12)15(19)13-10-22-8-6-16-13;/h3-4,9,13,16H,5-8,10H2,1-2H3;1H
InChIKeyPUONOYBINATSNP-UHFFFAOYSA-N
MW375.88 g/mol
LogP0.24
Rot. Bonds3

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

N,N-dimethyl-1-(morpholine-3-carbonyl)-2,3-dihydroindole-6-sulfonamide;hydrochloride (PubChem CID 119785866) has the molecular formula C15H22ClN3O4S and a molecular weight of 375.88 g/mol. Its IUPAC name is N,N-dimethyl-1-(morpholine-3-carbonyl)-2,3-dihydroindole-6-sulfonamide;hydrochloride.

Molecular Properties

Compound NameN,N-dimethyl-1-(morpholine-3-carbonyl)-2,3-dihydroindole-6-sulfonamide;hydrochloride
PubChem CID119785866
Molecular FormulaC15H22ClN3O4S
Molecular Weight375.88 g/mol
Exact Mass375.10
IUPAC NameN,N-dimethyl-1-(morpholine-3-carbonyl)-2,3-dihydroindole-6-sulfonamide;hydrochloride
SMILESCN(C)S(=O)(=O)c1ccc2c(c1)N(C(=O)C1COCCN1)CC2.Cl
InChIInChI=1S/C15H21N3O4S.ClH/c1-17(2)23(20,21)12-4-3-11-5-7-18(14(11)9-12)15(19)13-10-22-8-6-16-13;/h3-4,9,13,16H,5-8,10H2,1-2H3;1H
InChIKeyPUONOYBINATSNP-UHFFFAOYSA-N
XLogP0.24
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.88
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-dimethyl-1-(morpholine-2-carbonyl)-2,3-dihydroindole-6-sulfonamide;hydrochloride
CID 119785904
2,3-dihydroindol-1-yl(morpholin-3-yl)methanone;hydrochloride
CID 119673083
1-[4-(aminomethyl)oxane-4-carbonyl]-N,N-dimethyl-2,3-dihydroindole-6-sulfonamide;hydrochloride
CID 120932755
1-(1-aminocyclopentanecarbonyl)-N,N-dimethyl-2,3-dihydroindole-6-sulfonamide;hydrochloride
CID 119324921
1-[(2S)-2-aminopropanoyl]-N,N-dimethyl-2,3-dihydroindole-6-sulfonamide
CID 119324906
N,N-dimethyl-1-[2-(oxolan-2-yl)acetyl]-2,3-dihydroindole-6-sulfonamide
CID 56805828
N,N-dimethyl-1-(2-thiomorpholin-3-ylacetyl)-2,3-dihydroindole-6-sulfonamide
CID 119939189
[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-morpholin-3-ylmethanone;hydrochloride
CID 119687775
1-acetyl-N-methyl-N-piperidin-4-yl-2,3-dihydroindole-6-sulfonamide
CID 119966047
1-(2-amino-2-methylpentanoyl)-N,N-dimethyl-2,3-dihydroindole-6-sulfonamide;hydrochloride
CID 119785912
1-(6-chloropyridine-3-carbonyl)-N,N-dimethyl-2,3-dihydroindole-6-sulfonamide
CID 154797051
2-[6-(dimethylsulfamoyl)-2,3-dihydroindol-1-yl]acetic acid;hydrochloride
CID 119922066

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(morpholine-3-carbonyl)-2,3-dihydroindole-6-sulfonamide;hydrochloride?
The IUPAC name of N,N-dimethyl-1-(morpholine-3-carbonyl)-2,3-dihydroindole-6-sulfonamide;hydrochloride (CID 119785866) is N,N-dimethyl-1-(morpholine-3-carbonyl)-2,3-dihydroindole-6-sulfonamide;hydrochloride.
What is the SMILES notation for N,N-dimethyl-1-(morpholine-3-carbonyl)-2,3-dihydroindole-6-sulfonamide;hydrochloride?
The canonical SMILES for N,N-dimethyl-1-(morpholine-3-carbonyl)-2,3-dihydroindole-6-sulfonamide;hydrochloride is CN(C)S(=O)(=O)c1ccc2c(c1)N(C(=O)C1COCCN1)CC2.Cl.
What is the InChIKey of N,N-dimethyl-1-(morpholine-3-carbonyl)-2,3-dihydroindole-6-sulfonamide;hydrochloride?
The InChIKey is PUONOYBINATSNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O4S.ClH/c1-17(2)23(20,21)12-4-3-11-5-7-18(14(11)9-12)15(19)13-10-22-8-6-16-13;/h3-4,9,13,16H,5-8,10H2,1-2H3;1H.
What are the key properties of N,N-dimethyl-1-(morpholine-3-carbonyl)-2,3-dihydroindole-6-sulfonamide;hydrochloride?
N,N-dimethyl-1-(morpholine-3-carbonyl)-2,3-dihydroindole-6-sulfonamide;hydrochloride has a molecular weight of 375.88 g/mol, XLogP of 0.24, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(morpholine-3-carbonyl)-2,3-dihydroindole-6-sulfonamide;hydrochloride is sourced from PubChem (CID 119785866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).