(4-propan-2-ylphenyl)methanesulfonamide

C10H15NO2S — CID 43164314

IUPAC(4-propan-2-ylphenyl)methanesulfonamide
SMILESCC(C)c1ccc(CS(N)(=O)=O)cc1
InChIInChI=1S/C10H15NO2S/c1-8(2)10-5-3-9(4-6-10)7-14(11,12)13/h3-6,8H,7H2,1-2H3,(H2,11,12,13)
InChIKeyQUHGEDDAENKRCA-UHFFFAOYSA-N
MW213.30 g/mol
LogP1.60
Rot. Bonds3

About (4-propan-2-ylphenyl)methanesulfonamide

(4-propan-2-ylphenyl)methanesulfonamide (PubChem CID 43164314) has the molecular formula C10H15NO2S and a molecular weight of 213.30 g/mol. Its IUPAC name is (4-propan-2-ylphenyl)methanesulfonamide.

Molecular Properties

Compound Name(4-propan-2-ylphenyl)methanesulfonamide
PubChem CID43164314
Molecular FormulaC10H15NO2S
Molecular Weight213.30 g/mol
Exact Mass213.08
IUPAC Name(4-propan-2-ylphenyl)methanesulfonamide
SMILESCC(C)c1ccc(CS(N)(=O)=O)cc1
InChIInChI=1S/C10H15NO2S/c1-8(2)10-5-3-9(4-6-10)7-14(11,12)13/h3-6,8H,7H2,1-2H3,(H2,11,12,13)
InChIKeyQUHGEDDAENKRCA-UHFFFAOYSA-N
XLogP1.60
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.30
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-propan-2-ylphenyl)methanesulfonamide?
The IUPAC name of (4-propan-2-ylphenyl)methanesulfonamide (CID 43164314) is (4-propan-2-ylphenyl)methanesulfonamide.
What is the SMILES notation for (4-propan-2-ylphenyl)methanesulfonamide?
The canonical SMILES for (4-propan-2-ylphenyl)methanesulfonamide is CC(C)c1ccc(CS(N)(=O)=O)cc1.
What is the InChIKey of (4-propan-2-ylphenyl)methanesulfonamide?
The InChIKey is QUHGEDDAENKRCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S/c1-8(2)10-5-3-9(4-6-10)7-14(11,12)13/h3-6,8H,7H2,1-2H3,(H2,11,12,13).
What are the key properties of (4-propan-2-ylphenyl)methanesulfonamide?
(4-propan-2-ylphenyl)methanesulfonamide has a molecular weight of 213.30 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-propan-2-ylphenyl)methanesulfonamide is sourced from PubChem (CID 43164314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).