5-[(1R)-1-methylsulfanylethyl]-2-(1,1,2,2,2-pentafluoroethyl)pyridine

C10H10F5NS — CID 124566857

IUPAC5-[(1R)-1-methylsulfanylethyl]-2-(1,1,2,2,2-pentafluoroethyl)pyridine
SMILESCS[C@H](C)c1ccc(C(F)(F)C(F)(F)F)nc1
InChIInChI=1S/C10H10F5NS/c1-6(17-2)7-3-4-8(16-5-7)9(11,12)10(13,14)15/h3-6H,1-2H3/t6-/m1/s1
InChIKeyYIPCQPVZPCZJAV-ZCFIWIBFSA-N
MW271.25 g/mol
LogP4.16
Rot. Bonds3

About 5-[(1R)-1-methylsulfanylethyl]-2-(1,1,2,2,2-pentafluoroethyl)pyridine

5-[(1R)-1-methylsulfanylethyl]-2-(1,1,2,2,2-pentafluoroethyl)pyridine (PubChem CID 124566857) has the molecular formula C10H10F5NS and a molecular weight of 271.25 g/mol. Its IUPAC name is 5-[(1R)-1-methylsulfanylethyl]-2-(1,1,2,2,2-pentafluoroethyl)pyridine.

Molecular Properties

Compound Name5-[(1R)-1-methylsulfanylethyl]-2-(1,1,2,2,2-pentafluoroethyl)pyridine
PubChem CID124566857
Molecular FormulaC10H10F5NS
Molecular Weight271.25 g/mol
Exact Mass271.05
IUPAC Name5-[(1R)-1-methylsulfanylethyl]-2-(1,1,2,2,2-pentafluoroethyl)pyridine
SMILESCS[C@H](C)c1ccc(C(F)(F)C(F)(F)F)nc1
InChIInChI=1S/C10H10F5NS/c1-6(17-2)7-3-4-8(16-5-7)9(11,12)10(13,14)15/h3-6H,1-2H3/t6-/m1/s1
InChIKeyYIPCQPVZPCZJAV-ZCFIWIBFSA-N
XLogP4.16
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.25
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

2-[chloro(difluoro)methyl]-5-[(1R)-1-methylsulfanylethyl]pyridine
CID 124565984
2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-5-propan-2-ylpyridine
CID 135234346
[(1R)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]azanium
CID 164715814
2-[chloro(fluoro)methyl]-5-(1-methylsulfanylethyl)pyridine
CID 143527381
5-(1-iodoethyl)-2-(trifluoromethyl)pyridine
CID 142294771
1-[6-[chloro(difluoro)methyl]-3-pyridinyl]ethanethiol
CID 88935375
5-(1-chloroethyl)-2-[difluoro(iodo)methyl]pyridine
CID 89289651
5-[(2S)-butan-2-yl]-2-(trifluoromethyl)pyridine
CID 66695263
5-(1-sulfinylpropan-2-yl)-2-(trifluoromethyl)pyridine
CID 87392243
1-(1-methylsulfanylethyl)-4-propan-2-ylbenzene
CID 154539866
1-[6-(trifluoromethyl)-3-pyridinyl]ethylhydrazine;hydrochloride
CID 137356558
2-methoxy-5-(1-methylsulfanylethyl)pyrimidine
CID 148642376

Frequently Asked Questions

What is the IUPAC name of 5-[(1R)-1-methylsulfanylethyl]-2-(1,1,2,2,2-pentafluoroethyl)pyridine?
The IUPAC name of 5-[(1R)-1-methylsulfanylethyl]-2-(1,1,2,2,2-pentafluoroethyl)pyridine (CID 124566857) is 5-[(1R)-1-methylsulfanylethyl]-2-(1,1,2,2,2-pentafluoroethyl)pyridine.
What is the SMILES notation for 5-[(1R)-1-methylsulfanylethyl]-2-(1,1,2,2,2-pentafluoroethyl)pyridine?
The canonical SMILES for 5-[(1R)-1-methylsulfanylethyl]-2-(1,1,2,2,2-pentafluoroethyl)pyridine is CS[C@H](C)c1ccc(C(F)(F)C(F)(F)F)nc1.
What is the InChIKey of 5-[(1R)-1-methylsulfanylethyl]-2-(1,1,2,2,2-pentafluoroethyl)pyridine?
The InChIKey is YIPCQPVZPCZJAV-ZCFIWIBFSA-N. The full InChI is InChI=1S/C10H10F5NS/c1-6(17-2)7-3-4-8(16-5-7)9(11,12)10(13,14)15/h3-6H,1-2H3/t6-/m1/s1.
What are the key properties of 5-[(1R)-1-methylsulfanylethyl]-2-(1,1,2,2,2-pentafluoroethyl)pyridine?
5-[(1R)-1-methylsulfanylethyl]-2-(1,1,2,2,2-pentafluoroethyl)pyridine has a molecular weight of 271.25 g/mol, XLogP of 4.16, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(1R)-1-methylsulfanylethyl]-2-(1,1,2,2,2-pentafluoroethyl)pyridine is sourced from PubChem (CID 124566857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).