N-(4-tert-butylphenyl)-N-methylfuran-2-sulfonamide

C15H19NO3S — CID 136534235

IUPACN-(4-tert-butylphenyl)-N-methylfuran-2-sulfonamide
SMILESCN(c1ccc(C(C)(C)C)cc1)S(=O)(=O)c1ccco1
InChIInChI=1S/C15H19NO3S/c1-15(2,3)12-7-9-13(10-8-12)16(4)20(17,18)14-6-5-11-19-14/h5-11H,1-4H3
InChIKeyPQQYEEVHZACZBR-UHFFFAOYSA-N
MW293.39 g/mol
LogP3.40
Rot. Bonds3

About N-(4-tert-butylphenyl)-N-methylfuran-2-sulfonamide

N-(4-tert-butylphenyl)-N-methylfuran-2-sulfonamide (PubChem CID 136534235) has the molecular formula C15H19NO3S and a molecular weight of 293.39 g/mol. Its IUPAC name is N-(4-tert-butylphenyl)-N-methylfuran-2-sulfonamide.

Molecular Properties

Compound NameN-(4-tert-butylphenyl)-N-methylfuran-2-sulfonamide
PubChem CID136534235
Molecular FormulaC15H19NO3S
Molecular Weight293.39 g/mol
Exact Mass293.11
IUPAC NameN-(4-tert-butylphenyl)-N-methylfuran-2-sulfonamide
SMILESCN(c1ccc(C(C)(C)C)cc1)S(=O)(=O)c1ccco1
InChIInChI=1S/C15H19NO3S/c1-15(2,3)12-7-9-13(10-8-12)16(4)20(17,18)14-6-5-11-19-14/h5-11H,1-4H3
InChIKeyPQQYEEVHZACZBR-UHFFFAOYSA-N
XLogP3.40
TPSA50.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-tert-butylphenyl)-N-methylfuran-2-sulfonamide?
The IUPAC name of N-(4-tert-butylphenyl)-N-methylfuran-2-sulfonamide (CID 136534235) is N-(4-tert-butylphenyl)-N-methylfuran-2-sulfonamide.
What is the SMILES notation for N-(4-tert-butylphenyl)-N-methylfuran-2-sulfonamide?
The canonical SMILES for N-(4-tert-butylphenyl)-N-methylfuran-2-sulfonamide is CN(c1ccc(C(C)(C)C)cc1)S(=O)(=O)c1ccco1.
What is the InChIKey of N-(4-tert-butylphenyl)-N-methylfuran-2-sulfonamide?
The InChIKey is PQQYEEVHZACZBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO3S/c1-15(2,3)12-7-9-13(10-8-12)16(4)20(17,18)14-6-5-11-19-14/h5-11H,1-4H3.
What are the key properties of N-(4-tert-butylphenyl)-N-methylfuran-2-sulfonamide?
N-(4-tert-butylphenyl)-N-methylfuran-2-sulfonamide has a molecular weight of 293.39 g/mol, XLogP of 3.40, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-tert-butylphenyl)-N-methylfuran-2-sulfonamide is sourced from PubChem (CID 136534235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).