1-propyl-N-(2-sulfamoylethyl)indole-3-carboxamide

C14H19N3O3S — CID 51102367

IUPAC1-propyl-N-(2-sulfamoylethyl)indole-3-carboxamide
SMILESCCCn1cc(C(=O)NCCS(N)(=O)=O)c2ccccc21
InChIInChI=1S/C14H19N3O3S/c1-2-8-17-10-12(11-5-3-4-6-13(11)17)14(18)16-7-9-21(15,19)20/h3-6,10H,2,7-9H2,1H3,(H,16,18)(H2,15,19,20)
InChIKeyJCMYIGMCQAXFIA-UHFFFAOYSA-N
MW309.39 g/mol
LogP1.07
Rot. Bonds6

About 1-propyl-N-(2-sulfamoylethyl)indole-3-carboxamide

1-propyl-N-(2-sulfamoylethyl)indole-3-carboxamide (PubChem CID 51102367) has the molecular formula C14H19N3O3S and a molecular weight of 309.39 g/mol. Its IUPAC name is 1-propyl-N-(2-sulfamoylethyl)indole-3-carboxamide.

Molecular Properties

Compound Name1-propyl-N-(2-sulfamoylethyl)indole-3-carboxamide
PubChem CID51102367
Molecular FormulaC14H19N3O3S
Molecular Weight309.39 g/mol
Exact Mass309.11
IUPAC Name1-propyl-N-(2-sulfamoylethyl)indole-3-carboxamide
SMILESCCCn1cc(C(=O)NCCS(N)(=O)=O)c2ccccc21
InChIInChI=1S/C14H19N3O3S/c1-2-8-17-10-12(11-5-3-4-6-13(11)17)14(18)16-7-9-21(15,19)20/h3-6,10H,2,7-9H2,1H3,(H,16,18)(H2,15,19,20)
InChIKeyJCMYIGMCQAXFIA-UHFFFAOYSA-N
XLogP1.07
TPSA94.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.39
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-benzyl-N-propylindole-3-carboxamide
CID 24654500
ethyl 4-[3-(nonylcarbamoyl)indol-1-yl]butanoate
CID 22400562
N-(2-sulfamoylethyl)naphthalene-1-carboxamide
CID 61067529
N-ethyl-1-methylindole-3-carboxamide
CID 25348690
1-(2-ethylsulfonylethyl)indole-3-carboxylic acid
CID 43807959
4-[[1-(2-methoxyethyl)indole-3-carbonyl]amino]butanoic acid
CID 119170603
2-amino-N-(2-sulfamoylethyl)benzamide
CID 43551552
1-[2-(diethylamino)ethyl]-N-methylindole-3-carboxamide
CID 67785662
(4-methylphenyl)-(1-propylindol-3-yl)methanone
CID 170857121
6-[[1-(2-methoxyethyl)indole-3-carbonyl]amino]hexanoic acid
CID 119219776
N-[(2R)-oxan-2-yl]oxy-1-propylindole-3-carboxamide
CID 99792755
1-(2-methoxyethyl)-N-(2-pyridin-2-ylethyl)indole-3-carboxamide
CID 71704949

Frequently Asked Questions

What is the IUPAC name of 1-propyl-N-(2-sulfamoylethyl)indole-3-carboxamide?
The IUPAC name of 1-propyl-N-(2-sulfamoylethyl)indole-3-carboxamide (CID 51102367) is 1-propyl-N-(2-sulfamoylethyl)indole-3-carboxamide.
What is the SMILES notation for 1-propyl-N-(2-sulfamoylethyl)indole-3-carboxamide?
The canonical SMILES for 1-propyl-N-(2-sulfamoylethyl)indole-3-carboxamide is CCCn1cc(C(=O)NCCS(N)(=O)=O)c2ccccc21.
What is the InChIKey of 1-propyl-N-(2-sulfamoylethyl)indole-3-carboxamide?
The InChIKey is JCMYIGMCQAXFIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3S/c1-2-8-17-10-12(11-5-3-4-6-13(11)17)14(18)16-7-9-21(15,19)20/h3-6,10H,2,7-9H2,1H3,(H,16,18)(H2,15,19,20).
What are the key properties of 1-propyl-N-(2-sulfamoylethyl)indole-3-carboxamide?
1-propyl-N-(2-sulfamoylethyl)indole-3-carboxamide has a molecular weight of 309.39 g/mol, XLogP of 1.07, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propyl-N-(2-sulfamoylethyl)indole-3-carboxamide is sourced from PubChem (CID 51102367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).