6-(methylamino)-N-(1-methylcyclohexyl)pyridine-3-sulfonamide

C13H21N3O2S — CID 62158085

IUPAC6-(methylamino)-N-(1-methylcyclohexyl)pyridine-3-sulfonamide
SMILESCNc1ccc(S(=O)(=O)NC2(C)CCCCC2)cn1
InChIInChI=1S/C13H21N3O2S/c1-13(8-4-3-5-9-13)16-19(17,18)11-6-7-12(14-2)15-10-11/h6-7,10,16H,3-5,8-9H2,1-2H3,(H,14,15)
InChIKeyMJDYNUDORVJLCU-UHFFFAOYSA-N
MW283.40 g/mol
LogP2.12
Rot. Bonds4

About 6-(methylamino)-N-(1-methylcyclohexyl)pyridine-3-sulfonamide

6-(methylamino)-N-(1-methylcyclohexyl)pyridine-3-sulfonamide (PubChem CID 62158085) has the molecular formula C13H21N3O2S and a molecular weight of 283.40 g/mol. Its IUPAC name is 6-(methylamino)-N-(1-methylcyclohexyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-(methylamino)-N-(1-methylcyclohexyl)pyridine-3-sulfonamide
PubChem CID62158085
Molecular FormulaC13H21N3O2S
Molecular Weight283.40 g/mol
Exact Mass283.14
IUPAC Name6-(methylamino)-N-(1-methylcyclohexyl)pyridine-3-sulfonamide
SMILESCNc1ccc(S(=O)(=O)NC2(C)CCCCC2)cn1
InChIInChI=1S/C13H21N3O2S/c1-13(8-4-3-5-9-13)16-19(17,18)11-6-7-12(14-2)15-10-11/h6-7,10,16H,3-5,8-9H2,1-2H3,(H,14,15)
InChIKeyMJDYNUDORVJLCU-UHFFFAOYSA-N
XLogP2.12
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.40
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(methylamino)-N-(1-methylcyclohexyl)pyridine-3-sulfonamide?
The IUPAC name of 6-(methylamino)-N-(1-methylcyclohexyl)pyridine-3-sulfonamide (CID 62158085) is 6-(methylamino)-N-(1-methylcyclohexyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-(methylamino)-N-(1-methylcyclohexyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-(methylamino)-N-(1-methylcyclohexyl)pyridine-3-sulfonamide is CNc1ccc(S(=O)(=O)NC2(C)CCCCC2)cn1.
What is the InChIKey of 6-(methylamino)-N-(1-methylcyclohexyl)pyridine-3-sulfonamide?
The InChIKey is MJDYNUDORVJLCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2S/c1-13(8-4-3-5-9-13)16-19(17,18)11-6-7-12(14-2)15-10-11/h6-7,10,16H,3-5,8-9H2,1-2H3,(H,14,15).
What are the key properties of 6-(methylamino)-N-(1-methylcyclohexyl)pyridine-3-sulfonamide?
6-(methylamino)-N-(1-methylcyclohexyl)pyridine-3-sulfonamide has a molecular weight of 283.40 g/mol, XLogP of 2.12, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methylamino)-N-(1-methylcyclohexyl)pyridine-3-sulfonamide is sourced from PubChem (CID 62158085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).