2-(2-methylcyclohexyl)oxypyridine-3-sulfonamide

C12H18N2O3S — CID 112572937

IUPAC2-(2-methylcyclohexyl)oxypyridine-3-sulfonamide
SMILESCC1CCCCC1Oc1ncccc1S(N)(=O)=O
InChIInChI=1S/C12H18N2O3S/c1-9-5-2-3-6-10(9)17-12-11(18(13,15)16)7-4-8-14-12/h4,7-10H,2-3,5-6H2,1H3,(H2,13,15,16)
InChIKeyJNGUSNHGRIPFIN-UHFFFAOYSA-N
MW270.35 g/mol
LogP1.69
Rot. Bonds3

About 2-(2-methylcyclohexyl)oxypyridine-3-sulfonamide

2-(2-methylcyclohexyl)oxypyridine-3-sulfonamide (PubChem CID 112572937) has the molecular formula C12H18N2O3S and a molecular weight of 270.35 g/mol. Its IUPAC name is 2-(2-methylcyclohexyl)oxypyridine-3-sulfonamide.

Molecular Properties

Compound Name2-(2-methylcyclohexyl)oxypyridine-3-sulfonamide
PubChem CID112572937
Molecular FormulaC12H18N2O3S
Molecular Weight270.35 g/mol
Exact Mass270.10
IUPAC Name2-(2-methylcyclohexyl)oxypyridine-3-sulfonamide
SMILESCC1CCCCC1Oc1ncccc1S(N)(=O)=O
InChIInChI=1S/C12H18N2O3S/c1-9-5-2-3-6-10(9)17-12-11(18(13,15)16)7-4-8-14-12/h4,7-10H,2-3,5-6H2,1H3,(H2,13,15,16)
InChIKeyJNGUSNHGRIPFIN-UHFFFAOYSA-N
XLogP1.69
TPSA82.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylcyclohexyl)oxypyridine-3-sulfonamide?
The IUPAC name of 2-(2-methylcyclohexyl)oxypyridine-3-sulfonamide (CID 112572937) is 2-(2-methylcyclohexyl)oxypyridine-3-sulfonamide.
What is the SMILES notation for 2-(2-methylcyclohexyl)oxypyridine-3-sulfonamide?
The canonical SMILES for 2-(2-methylcyclohexyl)oxypyridine-3-sulfonamide is CC1CCCCC1Oc1ncccc1S(N)(=O)=O.
What is the InChIKey of 2-(2-methylcyclohexyl)oxypyridine-3-sulfonamide?
The InChIKey is JNGUSNHGRIPFIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3S/c1-9-5-2-3-6-10(9)17-12-11(18(13,15)16)7-4-8-14-12/h4,7-10H,2-3,5-6H2,1H3,(H2,13,15,16).
What are the key properties of 2-(2-methylcyclohexyl)oxypyridine-3-sulfonamide?
2-(2-methylcyclohexyl)oxypyridine-3-sulfonamide has a molecular weight of 270.35 g/mol, XLogP of 1.69, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylcyclohexyl)oxypyridine-3-sulfonamide is sourced from PubChem (CID 112572937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).