5-(dimethylsulfamoyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide

C21H26N4O5S — CID 24736632

IUPAC5-(dimethylsulfamoyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide
SMILESCN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)NC1CCN(C(=O)c2ccco2)CC1
InChIInChI=1S/C21H26N4O5S/c1-23(2)31(28,29)17-5-6-18-15(14-17)7-12-25(18)21(27)22-16-8-10-24(11-9-16)20(26)19-4-3-13-30-19/h3-6,13-14,16H,7-12H2,1-2H3,(H,22,27)
InChIKeyMJANZMCNSGOSBV-UHFFFAOYSA-N
MW446.53 g/mol
LogP1.91
Rot. Bonds4

About 5-(dimethylsulfamoyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide

5-(dimethylsulfamoyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide (PubChem CID 24736632) has the molecular formula C21H26N4O5S and a molecular weight of 446.53 g/mol. Its IUPAC name is 5-(dimethylsulfamoyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide.

Molecular Properties

Compound Name5-(dimethylsulfamoyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide
PubChem CID24736632
Molecular FormulaC21H26N4O5S
Molecular Weight446.53 g/mol
Exact Mass446.16
IUPAC Name5-(dimethylsulfamoyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide
SMILESCN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)NC1CCN(C(=O)c2ccco2)CC1
InChIInChI=1S/C21H26N4O5S/c1-23(2)31(28,29)17-5-6-18-15(14-17)7-12-25(18)21(27)22-16-8-10-24(11-9-16)20(26)19-4-3-13-30-19/h3-6,13-14,16H,7-12H2,1-2H3,(H,22,27)
InChIKeyMJANZMCNSGOSBV-UHFFFAOYSA-N
XLogP1.91
TPSA103.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500446.53
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(cyclohexylmethyl)piperidin-3-yl]-5-(dimethylsulfamoyl)-2,3-dihydroindole-1-carboxamide
CID 24736898
3-[5-(dimethylsulfamoyl)-1-methylbenzimidazol-2-yl]-N-[1-(furan-2-carbonyl)piperidin-4-yl]propanamide
CID 24646730
4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-N,N-dimethylbenzenesulfonamide
CID 34472481
N-[1-(ethylcarbamoyl)piperidin-4-yl]-5-methylsulfonyl-2,3-dihydroindole-1-carboxamide
CID 24736718
N-[1-[2-(cyclopropylamino)-3,4-dioxocyclobuten-1-yl]piperidin-3-yl]-5-(dimethylsulfamoyl)-2,3-dihydroindole-1-carboxamide
CID 24736793
1-(cyclopropanecarbonyl)-N-[3-[4-(furan-2-carbonyl)piperazin-1-yl]-3-oxopropyl]-2,3-dihydroindole-5-sulfonamide
CID 46361239
N,N-dimethyl-1-(1-methylpiperidine-4-carbonyl)-2,3-dihydroindole-5-sulfonamide
CID 50875375
furan-2-yl-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)methanone
CID 17416161
N,N-dimethyl-1-(3-phenylpropanoyl)-2,3-dihydroindole-5-sulfonamide
CID 26769525
5-chloro-N-[1-(furan-2-ylmethylcarbamoyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide
CID 24736716
N-cyclopentyl-1-[4-(dimethylsulfamoyl)benzoyl]-2,3-dihydroindole-5-sulfonamide
CID 19164501
N-cyclohexyl-5-[(3-methylphenyl)methylsulfamoyl]-2,3-dihydroindole-1-carboxamide
CID 53059167

Frequently Asked Questions

What is the IUPAC name of 5-(dimethylsulfamoyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide?
The IUPAC name of 5-(dimethylsulfamoyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide (CID 24736632) is 5-(dimethylsulfamoyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide.
What is the SMILES notation for 5-(dimethylsulfamoyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide?
The canonical SMILES for 5-(dimethylsulfamoyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide is CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)NC1CCN(C(=O)c2ccco2)CC1.
What is the InChIKey of 5-(dimethylsulfamoyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide?
The InChIKey is MJANZMCNSGOSBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4O5S/c1-23(2)31(28,29)17-5-6-18-15(14-17)7-12-25(18)21(27)22-16-8-10-24(11-9-16)20(26)19-4-3-13-30-19/h3-6,13-14,16H,7-12H2,1-2H3,(H,22,27).
What are the key properties of 5-(dimethylsulfamoyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide?
5-(dimethylsulfamoyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide has a molecular weight of 446.53 g/mol, XLogP of 1.91, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylsulfamoyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide is sourced from PubChem (CID 24736632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).