N-(4-propan-2-yloxyphenyl)piperidine-1-sulfonamide

C14H22N2O3S — CID 110705941

IUPACN-(4-propan-2-yloxyphenyl)piperidine-1-sulfonamide
SMILESCC(C)Oc1ccc(NS(=O)(=O)N2CCCCC2)cc1
InChIInChI=1S/C14H22N2O3S/c1-12(2)19-14-8-6-13(7-9-14)15-20(17,18)16-10-4-3-5-11-16/h6-9,12,15H,3-5,10-11H2,1-2H3
InChIKeySBRUIUFQARZNBY-UHFFFAOYSA-N
MW298.41 g/mol
LogP2.62
Rot. Bonds5

About N-(4-propan-2-yloxyphenyl)piperidine-1-sulfonamide

N-(4-propan-2-yloxyphenyl)piperidine-1-sulfonamide (PubChem CID 110705941) has the molecular formula C14H22N2O3S and a molecular weight of 298.41 g/mol. Its IUPAC name is N-(4-propan-2-yloxyphenyl)piperidine-1-sulfonamide.

Molecular Properties

Compound NameN-(4-propan-2-yloxyphenyl)piperidine-1-sulfonamide
PubChem CID110705941
Molecular FormulaC14H22N2O3S
Molecular Weight298.41 g/mol
Exact Mass298.14
IUPAC NameN-(4-propan-2-yloxyphenyl)piperidine-1-sulfonamide
SMILESCC(C)Oc1ccc(NS(=O)(=O)N2CCCCC2)cc1
InChIInChI=1S/C14H22N2O3S/c1-12(2)19-14-8-6-13(7-9-14)15-20(17,18)16-10-4-3-5-11-16/h6-9,12,15H,3-5,10-11H2,1-2H3
InChIKeySBRUIUFQARZNBY-UHFFFAOYSA-N
XLogP2.62
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.41
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 2988232
N-[4-(2-aminoethoxy)phenyl]piperidine-1-sulfonamide
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CID 45117555
N-(4-cyanophenyl)piperidine-1-sulfonamide
CID 28785044
3-piperidin-1-ylsulfonyl-N-(4-propan-2-yloxyphenyl)benzamide
CID 66872671
N-[4-(2-hydroxyethyl)phenyl]azepane-1-sulfonamide
CID 61223235
N-[4-(2-methylpropoxy)phenyl]piperazine-1-sulfonamide
CID 84760719
N-[4-(cyanomethyl)phenyl]piperidine-1-sulfonamide
CID 62303926
2-(4-propan-2-yloxyanilino)-1-pyrrolidin-1-ylpropan-1-one
CID 43123154
2-(piperidine-1-carbonyl)-N-(4-propan-2-yloxyphenyl)cyclopropane-1-carboxamide
CID 109132303
(E)-3-(3-piperidin-1-ylsulfonylphenyl)-N-(4-propan-2-yloxyphenyl)prop-2-enamide
CID 66872579
N-methyl-N-[(4-piperidin-1-ylphenyl)methyl]-2-[(4-propan-2-yloxyphenyl)sulfamoyl]acetamide
CID 55821184

Frequently Asked Questions

What is the IUPAC name of N-(4-propan-2-yloxyphenyl)piperidine-1-sulfonamide?
The IUPAC name of N-(4-propan-2-yloxyphenyl)piperidine-1-sulfonamide (CID 110705941) is N-(4-propan-2-yloxyphenyl)piperidine-1-sulfonamide.
What is the SMILES notation for N-(4-propan-2-yloxyphenyl)piperidine-1-sulfonamide?
The canonical SMILES for N-(4-propan-2-yloxyphenyl)piperidine-1-sulfonamide is CC(C)Oc1ccc(NS(=O)(=O)N2CCCCC2)cc1.
What is the InChIKey of N-(4-propan-2-yloxyphenyl)piperidine-1-sulfonamide?
The InChIKey is SBRUIUFQARZNBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3S/c1-12(2)19-14-8-6-13(7-9-14)15-20(17,18)16-10-4-3-5-11-16/h6-9,12,15H,3-5,10-11H2,1-2H3.
What are the key properties of N-(4-propan-2-yloxyphenyl)piperidine-1-sulfonamide?
N-(4-propan-2-yloxyphenyl)piperidine-1-sulfonamide has a molecular weight of 298.41 g/mol, XLogP of 2.62, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-propan-2-yloxyphenyl)piperidine-1-sulfonamide is sourced from PubChem (CID 110705941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).