2-fluoro-5-methyl-3-methylsulfanylpyridine

C7H8FNS — CID 164895334

IUPAC2-fluoro-5-methyl-3-methylsulfanylpyridine
SMILESCSc1cc(C)cnc1F
InChIInChI=1S/C7H8FNS/c1-5-3-6(10-2)7(8)9-4-5/h3-4H,1-2H3
InChIKeyTYSSRZMWWOJPJO-UHFFFAOYSA-N
MW157.21 g/mol
LogP2.25
Rot. Bonds1

About 2-fluoro-5-methyl-3-methylsulfanylpyridine

2-fluoro-5-methyl-3-methylsulfanylpyridine (PubChem CID 164895334) has the molecular formula C7H8FNS and a molecular weight of 157.21 g/mol. Its IUPAC name is 2-fluoro-5-methyl-3-methylsulfanylpyridine.

Molecular Properties

Compound Name2-fluoro-5-methyl-3-methylsulfanylpyridine
PubChem CID164895334
Molecular FormulaC7H8FNS
Molecular Weight157.21 g/mol
Exact Mass157.04
IUPAC Name2-fluoro-5-methyl-3-methylsulfanylpyridine
SMILESCSc1cc(C)cnc1F
InChIInChI=1S/C7H8FNS/c1-5-3-6(10-2)7(8)9-4-5/h3-4H,1-2H3
InChIKeyTYSSRZMWWOJPJO-UHFFFAOYSA-N
XLogP2.25
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2,5-dimethyl-3-methylsulfanylpyridine
CID 59938108
ethane;5-methyl-3-methylsulfanylpyridin-2-amine
CID 171527271
CID 144982231
CID 144982231
5-methyl-3-methylsulfanyl-2-[(E)-prop-1-enyl]pyridine
CID 142881167
(1R)-1-(2-fluoro-5-methyl-3-pyridinyl)-2-methylpropan-1-amine
CID 55276202
3-methyl-8-methylsulfanylquinoline
CID 119092882
2-fluoro-3-(2-fluorophenyl)-5-methylpyridine
CID 46312592
(2-fluoro-5-methyl-3-pyridinyl)oxyboronic acid
CID 142736729
1,4,5,8-tetrakis(methylsulfanyl)anthracene
CID 12637826
CID 89155806
CID 89155806
5-fluoro-2-methoxy-4-methylsulfanylpyridine
CID 147316298
2-fluoro-1,5-dimethyl-3-methylsulfanylbenzene
CID 130850117

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-methyl-3-methylsulfanylpyridine?
The IUPAC name of 2-fluoro-5-methyl-3-methylsulfanylpyridine (CID 164895334) is 2-fluoro-5-methyl-3-methylsulfanylpyridine.
What is the SMILES notation for 2-fluoro-5-methyl-3-methylsulfanylpyridine?
The canonical SMILES for 2-fluoro-5-methyl-3-methylsulfanylpyridine is CSc1cc(C)cnc1F.
What is the InChIKey of 2-fluoro-5-methyl-3-methylsulfanylpyridine?
The InChIKey is TYSSRZMWWOJPJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8FNS/c1-5-3-6(10-2)7(8)9-4-5/h3-4H,1-2H3.
What are the key properties of 2-fluoro-5-methyl-3-methylsulfanylpyridine?
2-fluoro-5-methyl-3-methylsulfanylpyridine has a molecular weight of 157.21 g/mol, XLogP of 2.25, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-methyl-3-methylsulfanylpyridine is sourced from PubChem (CID 164895334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).