(R)-N-[(S)-cyano-(3-methyloxetan-3-yl)methyl]-2-methylpropane-2-sulfinamide

C10H18N2O2S — CID 129389859

IUPAC(R)-N-[(S)-cyano-(3-methyloxetan-3-yl)methyl]-2-methylpropane-2-sulfinamide
SMILESCC1([C@@H](C#N)N[S@](=O)C(C)(C)C)COC1
InChIInChI=1S/C10H18N2O2S/c1-9(2,3)15(13)12-8(5-11)10(4)6-14-7-10/h8,12H,6-7H2,1-4H3/t8-,15-/m1/s1
InChIKeyQGOKKEUHZYHYES-ANRSDYALSA-N
MW230.33 g/mol
LogP0.97
Rot. Bonds3

About (R)-N-[(S)-cyano-(3-methyloxetan-3-yl)methyl]-2-methylpropane-2-sulfinamide

(R)-N-[(S)-cyano-(3-methyloxetan-3-yl)methyl]-2-methylpropane-2-sulfinamide (PubChem CID 129389859) has the molecular formula C10H18N2O2S and a molecular weight of 230.33 g/mol. Its IUPAC name is (R)-N-[(S)-cyano-(3-methyloxetan-3-yl)methyl]-2-methylpropane-2-sulfinamide.

Molecular Properties

Compound Name(R)-N-[(S)-cyano-(3-methyloxetan-3-yl)methyl]-2-methylpropane-2-sulfinamide
PubChem CID129389859
Molecular FormulaC10H18N2O2S
Molecular Weight230.33 g/mol
Exact Mass230.11
IUPAC Name(R)-N-[(S)-cyano-(3-methyloxetan-3-yl)methyl]-2-methylpropane-2-sulfinamide
SMILESCC1([C@@H](C#N)N[S@](=O)C(C)(C)C)COC1
InChIInChI=1S/C10H18N2O2S/c1-9(2,3)15(13)12-8(5-11)10(4)6-14-7-10/h8,12H,6-7H2,1-4H3/t8-,15-/m1/s1
InChIKeyQGOKKEUHZYHYES-ANRSDYALSA-N
XLogP0.97
TPSA62.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.33
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (R)-N-[(S)-cyano-(3-methyloxetan-3-yl)methyl]-2-methylpropane-2-sulfinamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[cyano-(3-methyloxetan-3-yl)methyl]-2-methyl-propane-2-sulfinamide
CID 90204320
2-methyl-N-[1-(3-methyloxetan-3-yl)ethyl]propane-2-sulfinamide
CID 117778989
2-(Tert-butylsulfanylamino)-2-(3-methyloxetan-3-yl)acetonitrile
CID 129238361
N-[(S)-cyano-(3-methyloxetan-3-yl)methyl]-2-methylpropane-2-sulfinamide
CID 130314946
(R)-N-[(R)-cyano-(3-methyloxetan-3-yl)methyl]-2-methylpropane-2-sulfinamide
CID 129389857
(S)-N-[(R)-cyano-(3-methyloxetan-3-yl)methyl]-2-methylpropane-2-sulfinamide
CID 129389858
(S)-N-[(S)-cyano-(3-methyloxetan-3-yl)methyl]-2-methylpropane-2-sulfinamide
CID 129389860

Frequently Asked Questions

What is the IUPAC name of (R)-N-[(S)-cyano-(3-methyloxetan-3-yl)methyl]-2-methylpropane-2-sulfinamide?
The IUPAC name of (R)-N-[(S)-cyano-(3-methyloxetan-3-yl)methyl]-2-methylpropane-2-sulfinamide (CID 129389859) is (R)-N-[(S)-cyano-(3-methyloxetan-3-yl)methyl]-2-methylpropane-2-sulfinamide.
What is the SMILES notation for (R)-N-[(S)-cyano-(3-methyloxetan-3-yl)methyl]-2-methylpropane-2-sulfinamide?
The canonical SMILES for (R)-N-[(S)-cyano-(3-methyloxetan-3-yl)methyl]-2-methylpropane-2-sulfinamide is CC1([C@@H](C#N)N[S@](=O)C(C)(C)C)COC1.
What is the InChIKey of (R)-N-[(S)-cyano-(3-methyloxetan-3-yl)methyl]-2-methylpropane-2-sulfinamide?
The InChIKey is QGOKKEUHZYHYES-ANRSDYALSA-N. The full InChI is InChI=1S/C10H18N2O2S/c1-9(2,3)15(13)12-8(5-11)10(4)6-14-7-10/h8,12H,6-7H2,1-4H3/t8-,15-/m1/s1.
What are the key properties of (R)-N-[(S)-cyano-(3-methyloxetan-3-yl)methyl]-2-methylpropane-2-sulfinamide?
(R)-N-[(S)-cyano-(3-methyloxetan-3-yl)methyl]-2-methylpropane-2-sulfinamide has a molecular weight of 230.33 g/mol, XLogP of 0.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-N-[(S)-cyano-(3-methyloxetan-3-yl)methyl]-2-methylpropane-2-sulfinamide is sourced from PubChem (CID 129389859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).