(2R)-2-methyl-3-propan-2-ylthietane

C7H14S — CID 118612980

IUPAC(2R)-2-methyl-3-propan-2-ylthietane
SMILESCC(C)C1CS[C@@H]1C
InChIInChI=1S/C7H14S/c1-5(2)7-4-8-6(7)3/h5-7H,4H2,1-3H3/t6-,7?/m1/s1
InChIKeyWWOYCTSGSIHDCP-ULUSZKPHSA-N
MW130.26 g/mol
LogP2.39
Rot. Bonds1

About (2R)-2-methyl-3-propan-2-ylthietane

(2R)-2-methyl-3-propan-2-ylthietane (PubChem CID 118612980) has the molecular formula C7H14S and a molecular weight of 130.26 g/mol. Its IUPAC name is (2R)-2-methyl-3-propan-2-ylthietane.

Molecular Properties

Compound Name(2R)-2-methyl-3-propan-2-ylthietane
PubChem CID118612980
Molecular FormulaC7H14S
Molecular Weight130.26 g/mol
Exact Mass130.08
IUPAC Name(2R)-2-methyl-3-propan-2-ylthietane
SMILESCC(C)C1CS[C@@H]1C
InChIInChI=1S/C7H14S/c1-5(2)7-4-8-6(7)3/h5-7H,4H2,1-3H3/t6-,7?/m1/s1
InChIKeyWWOYCTSGSIHDCP-ULUSZKPHSA-N
XLogP2.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.26
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-2,3-dimethylthietane
CID 130381786
(2R,3S)-2,3-dimethylthietane
CID 162937178
3-methyl-4-propan-2-ylthiolane
CID 59596318
2-propan-2-ylthiirane;hydrochloride
CID 175181688
azane;1-methyl-2-propan-2-ylcyclopropane
CID 21258764
ethane;1-methyl-2-propan-2-ylcyclopropane
CID 143332059
(2R)-2-methyl-1-methylidene-3-propan-2-ylthietane
CID 159949439
(2S)-1-methyl-2-propan-2-ylcyclobutane;yttrium
CID 59776230
(1R)-1-methyl-2-propan-2-ylcyclobutane
CID 158704963
cis-(1S,2R)-1,2-dimethylcyclopropane;ethane;methane;trans-(1S,2R)-1-methyl-2-propan-2-ylcyclopropane
CID 158862378
(1S)-1,2-di(propan-2-yl)cyclopentane
CID 161356354
trans-(1R,2S)-1-tert-butyl-2-propan-2-ylcyclopropane
CID 167553604

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-3-propan-2-ylthietane?
The IUPAC name of (2R)-2-methyl-3-propan-2-ylthietane (CID 118612980) is (2R)-2-methyl-3-propan-2-ylthietane.
What is the SMILES notation for (2R)-2-methyl-3-propan-2-ylthietane?
The canonical SMILES for (2R)-2-methyl-3-propan-2-ylthietane is CC(C)C1CS[C@@H]1C.
What is the InChIKey of (2R)-2-methyl-3-propan-2-ylthietane?
The InChIKey is WWOYCTSGSIHDCP-ULUSZKPHSA-N. The full InChI is InChI=1S/C7H14S/c1-5(2)7-4-8-6(7)3/h5-7H,4H2,1-3H3/t6-,7?/m1/s1.
What are the key properties of (2R)-2-methyl-3-propan-2-ylthietane?
(2R)-2-methyl-3-propan-2-ylthietane has a molecular weight of 130.26 g/mol, XLogP of 2.39, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-3-propan-2-ylthietane is sourced from PubChem (CID 118612980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).