2-(tert-butylsulfonimidoyl)phenol

C10H15NO2S — CID 25041022

IUPAC2-(tert-butylsulfonimidoyl)phenol
SMILES[H]N=[S@](=O)(c1ccccc1O)C(C)(C)C
InChIInChI=1S/C10H15NO2S/c1-10(2,3)14(11,13)9-7-5-4-6-8(9)12/h4-7,11-12H,1-3H3/t14-/m0/s1
InChIKeyPNHZVYASIOKLDG-AWEZNQCLSA-N
MW213.30 g/mol
LogP2.60
Rot. Bonds1

About 2-(tert-butylsulfonimidoyl)phenol

2-(tert-butylsulfonimidoyl)phenol (PubChem CID 25041022) has the molecular formula C10H15NO2S and a molecular weight of 213.30 g/mol. Its IUPAC name is 2-(tert-butylsulfonimidoyl)phenol.

Molecular Properties

Compound Name2-(tert-butylsulfonimidoyl)phenol
PubChem CID25041022
Molecular FormulaC10H15NO2S
Molecular Weight213.30 g/mol
Exact Mass213.08
IUPAC Name2-(tert-butylsulfonimidoyl)phenol
SMILES[H]N=[S@](=O)(c1ccccc1O)C(C)(C)C
InChIInChI=1S/C10H15NO2S/c1-10(2,3)14(11,13)9-7-5-4-6-8(9)12/h4-7,11-12H,1-3H3/t14-/m0/s1
InChIKeyPNHZVYASIOKLDG-AWEZNQCLSA-N
XLogP2.60
TPSA61.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.30
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(propan-2-ylsulfonimidoyl)phenol
CID 130034492
2-(triethyl-λ4-sulfanyl)phenol
CID 139364541
2-(trifluoromethylsulfonyl)phenol
CID 15731663
formaldehyde;2-(2-hydroxyphenyl)sulfonylphenol
CID 6452549
2-propan-2-ylsulfonylphenol
CID 587650
2-hydroxybenzenesulfonic acid;N-methylmethanamine
CID 87510356
(2-fluorophenyl)-imino-oxo-(trifluoromethyl)-λ6-sulfane
CID 132598581
2-(2-fluoroethylsulfonyl)phenol
CID 84672153
2-hydroxy-N-methyl-N-pentan-3-ylbenzenesulfonamide
CID 81241920
2-hydroxy-N-propan-2-yl-N-(2,2,2-trifluoroethyl)benzenesulfonamide
CID 81242025
2-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzenesulfonamide
CID 81245129
2-(4-methylphenyl)sulfonylphenol
CID 10879464

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylsulfonimidoyl)phenol?
The IUPAC name of 2-(tert-butylsulfonimidoyl)phenol (CID 25041022) is 2-(tert-butylsulfonimidoyl)phenol.
What is the SMILES notation for 2-(tert-butylsulfonimidoyl)phenol?
The canonical SMILES for 2-(tert-butylsulfonimidoyl)phenol is [H]N=[S@](=O)(c1ccccc1O)C(C)(C)C.
What is the InChIKey of 2-(tert-butylsulfonimidoyl)phenol?
The InChIKey is PNHZVYASIOKLDG-AWEZNQCLSA-N. The full InChI is InChI=1S/C10H15NO2S/c1-10(2,3)14(11,13)9-7-5-4-6-8(9)12/h4-7,11-12H,1-3H3/t14-/m0/s1.
What are the key properties of 2-(tert-butylsulfonimidoyl)phenol?
2-(tert-butylsulfonimidoyl)phenol has a molecular weight of 213.30 g/mol, XLogP of 2.60, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylsulfonimidoyl)phenol is sourced from PubChem (CID 25041022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).