6-(ethylamino)-N-(2-ethylcyclohexyl)pyridine-3-sulfonamide

C15H25N3O2S — CID 62152931

IUPAC6-(ethylamino)-N-(2-ethylcyclohexyl)pyridine-3-sulfonamide
SMILESCCNc1ccc(S(=O)(=O)NC2CCCCC2CC)cn1
InChIInChI=1S/C15H25N3O2S/c1-3-12-7-5-6-8-14(12)18-21(19,20)13-9-10-15(16-4-2)17-11-13/h9-12,14,18H,3-8H2,1-2H3,(H,16,17)
InChIKeyKBDWUTNSCGXNAA-UHFFFAOYSA-N
MW311.45 g/mol
LogP2.76
Rot. Bonds6

About 6-(ethylamino)-N-(2-ethylcyclohexyl)pyridine-3-sulfonamide

6-(ethylamino)-N-(2-ethylcyclohexyl)pyridine-3-sulfonamide (PubChem CID 62152931) has the molecular formula C15H25N3O2S and a molecular weight of 311.45 g/mol. Its IUPAC name is 6-(ethylamino)-N-(2-ethylcyclohexyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-(ethylamino)-N-(2-ethylcyclohexyl)pyridine-3-sulfonamide
PubChem CID62152931
Molecular FormulaC15H25N3O2S
Molecular Weight311.45 g/mol
Exact Mass311.17
IUPAC Name6-(ethylamino)-N-(2-ethylcyclohexyl)pyridine-3-sulfonamide
SMILESCCNc1ccc(S(=O)(=O)NC2CCCCC2CC)cn1
InChIInChI=1S/C15H25N3O2S/c1-3-12-7-5-6-8-14(12)18-21(19,20)13-9-10-15(16-4-2)17-11-13/h9-12,14,18H,3-8H2,1-2H3,(H,16,17)
InChIKeyKBDWUTNSCGXNAA-UHFFFAOYSA-N
XLogP2.76
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.45
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(ethylamino)-N-(2-ethylcyclohexyl)pyridine-3-sulfonamide?
The IUPAC name of 6-(ethylamino)-N-(2-ethylcyclohexyl)pyridine-3-sulfonamide (CID 62152931) is 6-(ethylamino)-N-(2-ethylcyclohexyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-(ethylamino)-N-(2-ethylcyclohexyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-(ethylamino)-N-(2-ethylcyclohexyl)pyridine-3-sulfonamide is CCNc1ccc(S(=O)(=O)NC2CCCCC2CC)cn1.
What is the InChIKey of 6-(ethylamino)-N-(2-ethylcyclohexyl)pyridine-3-sulfonamide?
The InChIKey is KBDWUTNSCGXNAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2S/c1-3-12-7-5-6-8-14(12)18-21(19,20)13-9-10-15(16-4-2)17-11-13/h9-12,14,18H,3-8H2,1-2H3,(H,16,17).
What are the key properties of 6-(ethylamino)-N-(2-ethylcyclohexyl)pyridine-3-sulfonamide?
6-(ethylamino)-N-(2-ethylcyclohexyl)pyridine-3-sulfonamide has a molecular weight of 311.45 g/mol, XLogP of 2.76, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylamino)-N-(2-ethylcyclohexyl)pyridine-3-sulfonamide is sourced from PubChem (CID 62152931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).