(4R)-4-methyl-2-[2-(1-methylcyclopentyl)ethyl]-1,3-thiazolidine

C12H23NS — CID 59102563

IUPAC(4R)-4-methyl-2-[2-(1-methylcyclopentyl)ethyl]-1,3-thiazolidine
SMILESC[C@@H]1CSC(CCC2(C)CCCC2)N1
InChIInChI=1S/C12H23NS/c1-10-9-14-11(13-10)5-8-12(2)6-3-4-7-12/h10-11,13H,3-9H2,1-2H3/t10-,11?/m1/s1
InChIKeyZORGHESSYMBCPJ-NFJWQWPMSA-N
MW213.39 g/mol
LogP3.40
Rot. Bonds3

About (4R)-4-methyl-2-[2-(1-methylcyclopentyl)ethyl]-1,3-thiazolidine

(4R)-4-methyl-2-[2-(1-methylcyclopentyl)ethyl]-1,3-thiazolidine (PubChem CID 59102563) has the molecular formula C12H23NS and a molecular weight of 213.39 g/mol. Its IUPAC name is (4R)-4-methyl-2-[2-(1-methylcyclopentyl)ethyl]-1,3-thiazolidine.

Molecular Properties

Compound Name(4R)-4-methyl-2-[2-(1-methylcyclopentyl)ethyl]-1,3-thiazolidine
PubChem CID59102563
Molecular FormulaC12H23NS
Molecular Weight213.39 g/mol
Exact Mass213.16
IUPAC Name(4R)-4-methyl-2-[2-(1-methylcyclopentyl)ethyl]-1,3-thiazolidine
SMILESC[C@@H]1CSC(CCC2(C)CCCC2)N1
InChIInChI=1S/C12H23NS/c1-10-9-14-11(13-10)5-8-12(2)6-3-4-7-12/h10-11,13H,3-9H2,1-2H3/t10-,11?/m1/s1
InChIKeyZORGHESSYMBCPJ-NFJWQWPMSA-N
XLogP3.40
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.39
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4R)-4-methyl-2-[2-(1-methylcyclopentyl)ethyl]-1,3-thiazolidine?
The IUPAC name of (4R)-4-methyl-2-[2-(1-methylcyclopentyl)ethyl]-1,3-thiazolidine (CID 59102563) is (4R)-4-methyl-2-[2-(1-methylcyclopentyl)ethyl]-1,3-thiazolidine.
What is the SMILES notation for (4R)-4-methyl-2-[2-(1-methylcyclopentyl)ethyl]-1,3-thiazolidine?
The canonical SMILES for (4R)-4-methyl-2-[2-(1-methylcyclopentyl)ethyl]-1,3-thiazolidine is C[C@@H]1CSC(CCC2(C)CCCC2)N1.
What is the InChIKey of (4R)-4-methyl-2-[2-(1-methylcyclopentyl)ethyl]-1,3-thiazolidine?
The InChIKey is ZORGHESSYMBCPJ-NFJWQWPMSA-N. The full InChI is InChI=1S/C12H23NS/c1-10-9-14-11(13-10)5-8-12(2)6-3-4-7-12/h10-11,13H,3-9H2,1-2H3/t10-,11?/m1/s1.
What are the key properties of (4R)-4-methyl-2-[2-(1-methylcyclopentyl)ethyl]-1,3-thiazolidine?
(4R)-4-methyl-2-[2-(1-methylcyclopentyl)ethyl]-1,3-thiazolidine has a molecular weight of 213.39 g/mol, XLogP of 3.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-methyl-2-[2-(1-methylcyclopentyl)ethyl]-1,3-thiazolidine is sourced from PubChem (CID 59102563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).