N-[(2R)-3,3-dimethylbutan-2-yl]-2-methylpropane-2-sulfinamide

C10H23NOS — CID 102403460

IUPACN-[(2R)-3,3-dimethylbutan-2-yl]-2-methylpropane-2-sulfinamide
SMILESC[C@@H](NS(=O)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C10H23NOS/c1-8(9(2,3)4)11-13(12)10(5,6)7/h8,11H,1-7H3/t8-,13?/m1/s1
InChIKeyZWXBRNYRQVOEHW-UOGPZTOASA-N
MW205.37 g/mol
LogP2.47
Rot. Bonds2

About N-[(2R)-3,3-dimethylbutan-2-yl]-2-methylpropane-2-sulfinamide

N-[(2R)-3,3-dimethylbutan-2-yl]-2-methylpropane-2-sulfinamide (PubChem CID 102403460) has the molecular formula C10H23NOS and a molecular weight of 205.37 g/mol. Its IUPAC name is N-[(2R)-3,3-dimethylbutan-2-yl]-2-methylpropane-2-sulfinamide.

Molecular Properties

Compound NameN-[(2R)-3,3-dimethylbutan-2-yl]-2-methylpropane-2-sulfinamide
PubChem CID102403460
Molecular FormulaC10H23NOS
Molecular Weight205.37 g/mol
Exact Mass205.15
IUPAC NameN-[(2R)-3,3-dimethylbutan-2-yl]-2-methylpropane-2-sulfinamide
SMILESC[C@@H](NS(=O)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C10H23NOS/c1-8(9(2,3)4)11-13(12)10(5,6)7/h8,11H,1-7H3/t8-,13?/m1/s1
InChIKeyZWXBRNYRQVOEHW-UOGPZTOASA-N
XLogP2.47
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.37
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-N-[(3S)-2-methylpentan-3-yl]propane-2-sulfinamide
CID 101468580
(R)-N-[(2R)-butan-2-yl]-2-methylpropane-2-sulfinamide
CID 135056564
(S)-2-methyl-N-[(2S)-pentan-2-yl]propane-2-sulfinamide
CID 135057244
(3S)-3-[[(R)-tert-butylsulfinyl]amino]-4-methylpentanoic acid
CID 11031847
N-[(3S,5S)-5-hydroxy-2,6,6-trimethylheptan-3-yl]-2-methylpropane-2-sulfinamide
CID 53487465
(R)-N-[(2S)-3-fluoro-4-methylpent-3-en-2-yl]-2-methylpropane-2-sulfinamide
CID 176786703
(R)-2-methyl-N-[(1R)-2-methyl-1-phenylpropyl]propane-2-sulfinamide
CID 15455980
N-[(2R)-hexan-2-yl]-2-methylpropane-2-sulfinamide
CID 101035801
methyl (2R,3R)-3-(tert-butylsulfinylamino)-2-hydroxy-2,4-dimethylpentanoate
CID 102319727
N-[(3R)-2-chloro-2-methylpentan-3-yl]-2-methylpropane-2-sulfinamide
CID 102254700
(S)-N-[(1S)-1-(4-bromophenyl)ethyl]-2-methylpropane-2-sulfinamide
CID 86732639
ethyl (2S)-2-[[(R)-tert-butylsulfinyl]amino]propanoate
CID 10751477

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-3,3-dimethylbutan-2-yl]-2-methylpropane-2-sulfinamide?
The IUPAC name of N-[(2R)-3,3-dimethylbutan-2-yl]-2-methylpropane-2-sulfinamide (CID 102403460) is N-[(2R)-3,3-dimethylbutan-2-yl]-2-methylpropane-2-sulfinamide.
What is the SMILES notation for N-[(2R)-3,3-dimethylbutan-2-yl]-2-methylpropane-2-sulfinamide?
The canonical SMILES for N-[(2R)-3,3-dimethylbutan-2-yl]-2-methylpropane-2-sulfinamide is C[C@@H](NS(=O)C(C)(C)C)C(C)(C)C.
What is the InChIKey of N-[(2R)-3,3-dimethylbutan-2-yl]-2-methylpropane-2-sulfinamide?
The InChIKey is ZWXBRNYRQVOEHW-UOGPZTOASA-N. The full InChI is InChI=1S/C10H23NOS/c1-8(9(2,3)4)11-13(12)10(5,6)7/h8,11H,1-7H3/t8-,13?/m1/s1.
What are the key properties of N-[(2R)-3,3-dimethylbutan-2-yl]-2-methylpropane-2-sulfinamide?
N-[(2R)-3,3-dimethylbutan-2-yl]-2-methylpropane-2-sulfinamide has a molecular weight of 205.37 g/mol, XLogP of 2.47, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-3,3-dimethylbutan-2-yl]-2-methylpropane-2-sulfinamide is sourced from PubChem (CID 102403460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).