(3R)-1-(2-methyl-1H-indole-3-carbonyl)piperidine-3-sulfonamide

C15H19N3O3S — CID 95905379

IUPAC(3R)-1-(2-methyl-1H-indole-3-carbonyl)piperidine-3-sulfonamide
SMILESCc1[nH]c2ccccc2c1C(=O)N1CCC[C@@H](S(N)(=O)=O)C1
InChIInChI=1S/C15H19N3O3S/c1-10-14(12-6-2-3-7-13(12)17-10)15(19)18-8-4-5-11(9-18)22(16,20)21/h2-3,6-7,11,17H,4-5,8-9H2,1H3,(H2,16,20,21)/t11-/m1/s1
InChIKeyHAMFWHZKCXOIQT-LLVKDONJSA-N
MW321.40 g/mol
LogP1.37
Rot. Bonds2

About (3R)-1-(2-methyl-1H-indole-3-carbonyl)piperidine-3-sulfonamide

(3R)-1-(2-methyl-1H-indole-3-carbonyl)piperidine-3-sulfonamide (PubChem CID 95905379) has the molecular formula C15H19N3O3S and a molecular weight of 321.40 g/mol. Its IUPAC name is (3R)-1-(2-methyl-1H-indole-3-carbonyl)piperidine-3-sulfonamide.

Molecular Properties

Compound Name(3R)-1-(2-methyl-1H-indole-3-carbonyl)piperidine-3-sulfonamide
PubChem CID95905379
Molecular FormulaC15H19N3O3S
Molecular Weight321.40 g/mol
Exact Mass321.11
IUPAC Name(3R)-1-(2-methyl-1H-indole-3-carbonyl)piperidine-3-sulfonamide
SMILESCc1[nH]c2ccccc2c1C(=O)N1CCC[C@@H](S(N)(=O)=O)C1
InChIInChI=1S/C15H19N3O3S/c1-10-14(12-6-2-3-7-13(12)17-10)15(19)18-8-4-5-11(9-18)22(16,20)21/h2-3,6-7,11,17H,4-5,8-9H2,1H3,(H2,16,20,21)/t11-/m1/s1
InChIKeyHAMFWHZKCXOIQT-LLVKDONJSA-N
XLogP1.37
TPSA96.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.40
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R)-1-(2-methyl-1H-indole-3-carbonyl)piperidine-3-sulfonamide?
The IUPAC name of (3R)-1-(2-methyl-1H-indole-3-carbonyl)piperidine-3-sulfonamide (CID 95905379) is (3R)-1-(2-methyl-1H-indole-3-carbonyl)piperidine-3-sulfonamide.
What is the SMILES notation for (3R)-1-(2-methyl-1H-indole-3-carbonyl)piperidine-3-sulfonamide?
The canonical SMILES for (3R)-1-(2-methyl-1H-indole-3-carbonyl)piperidine-3-sulfonamide is Cc1[nH]c2ccccc2c1C(=O)N1CCC[C@@H](S(N)(=O)=O)C1.
What is the InChIKey of (3R)-1-(2-methyl-1H-indole-3-carbonyl)piperidine-3-sulfonamide?
The InChIKey is HAMFWHZKCXOIQT-LLVKDONJSA-N. The full InChI is InChI=1S/C15H19N3O3S/c1-10-14(12-6-2-3-7-13(12)17-10)15(19)18-8-4-5-11(9-18)22(16,20)21/h2-3,6-7,11,17H,4-5,8-9H2,1H3,(H2,16,20,21)/t11-/m1/s1.
What are the key properties of (3R)-1-(2-methyl-1H-indole-3-carbonyl)piperidine-3-sulfonamide?
(3R)-1-(2-methyl-1H-indole-3-carbonyl)piperidine-3-sulfonamide has a molecular weight of 321.40 g/mol, XLogP of 1.37, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(2-methyl-1H-indole-3-carbonyl)piperidine-3-sulfonamide is sourced from PubChem (CID 95905379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).