5-chloro-3-[methyl(oxan-4-yl)sulfamoyl]-1H-indole-2-carboxamide

C15H18ClN3O4S — CID 10067849

IUPAC5-chloro-3-[methyl(oxan-4-yl)sulfamoyl]-1H-indole-2-carboxamide
SMILESCN(C1CCOCC1)S(=O)(=O)c1c(C(N)=O)[nH]c2ccc(Cl)cc12
InChIInChI=1S/C15H18ClN3O4S/c1-19(10-4-6-23-7-5-10)24(21,22)14-11-8-9(16)2-3-12(11)18-13(14)15(17)20/h2-3,8,10,18H,4-7H2,1H3,(H2,17,20)
InChIKeyCNWIDDOLGPQZQE-UHFFFAOYSA-N
MW371.85 g/mol
LogP1.72
Rot. Bonds4

About 5-chloro-3-[methyl(oxan-4-yl)sulfamoyl]-1H-indole-2-carboxamide

5-chloro-3-[methyl(oxan-4-yl)sulfamoyl]-1H-indole-2-carboxamide (PubChem CID 10067849) has the molecular formula C15H18ClN3O4S and a molecular weight of 371.85 g/mol. Its IUPAC name is 5-chloro-3-[methyl(oxan-4-yl)sulfamoyl]-1H-indole-2-carboxamide.

Molecular Properties

Compound Name5-chloro-3-[methyl(oxan-4-yl)sulfamoyl]-1H-indole-2-carboxamide
PubChem CID10067849
Molecular FormulaC15H18ClN3O4S
Molecular Weight371.85 g/mol
Exact Mass371.07
IUPAC Name5-chloro-3-[methyl(oxan-4-yl)sulfamoyl]-1H-indole-2-carboxamide
SMILESCN(C1CCOCC1)S(=O)(=O)c1c(C(N)=O)[nH]c2ccc(Cl)cc12
InChIInChI=1S/C15H18ClN3O4S/c1-19(10-4-6-23-7-5-10)24(21,22)14-11-8-9(16)2-3-12(11)18-13(14)15(17)20/h2-3,8,10,18H,4-7H2,1H3,(H2,17,20)
InChIKeyCNWIDDOLGPQZQE-UHFFFAOYSA-N
XLogP1.72
TPSA105.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.85
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-[methyl(oxan-4-yl)sulfamoyl]-1H-indole-2-carboxamide?
The IUPAC name of 5-chloro-3-[methyl(oxan-4-yl)sulfamoyl]-1H-indole-2-carboxamide (CID 10067849) is 5-chloro-3-[methyl(oxan-4-yl)sulfamoyl]-1H-indole-2-carboxamide.
What is the SMILES notation for 5-chloro-3-[methyl(oxan-4-yl)sulfamoyl]-1H-indole-2-carboxamide?
The canonical SMILES for 5-chloro-3-[methyl(oxan-4-yl)sulfamoyl]-1H-indole-2-carboxamide is CN(C1CCOCC1)S(=O)(=O)c1c(C(N)=O)[nH]c2ccc(Cl)cc12.
What is the InChIKey of 5-chloro-3-[methyl(oxan-4-yl)sulfamoyl]-1H-indole-2-carboxamide?
The InChIKey is CNWIDDOLGPQZQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClN3O4S/c1-19(10-4-6-23-7-5-10)24(21,22)14-11-8-9(16)2-3-12(11)18-13(14)15(17)20/h2-3,8,10,18H,4-7H2,1H3,(H2,17,20).
What are the key properties of 5-chloro-3-[methyl(oxan-4-yl)sulfamoyl]-1H-indole-2-carboxamide?
5-chloro-3-[methyl(oxan-4-yl)sulfamoyl]-1H-indole-2-carboxamide has a molecular weight of 371.85 g/mol, XLogP of 1.72, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-[methyl(oxan-4-yl)sulfamoyl]-1H-indole-2-carboxamide is sourced from PubChem (CID 10067849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).