2-(thiophen-2-ylsulfinylmethyl)pyridine

C10H9NOS2 — CID 56639480

IUPAC2-(thiophen-2-ylsulfinylmethyl)pyridine
SMILESO=S(Cc1ccccn1)c1cccs1
InChIInChI=1S/C10H9NOS2/c12-14(10-5-3-7-13-10)8-9-4-1-2-6-11-9/h1-7H,8H2
InChIKeyPHUNWXSDBIRYMJ-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.45
Rot. Bonds3

About 2-(thiophen-2-ylsulfinylmethyl)pyridine

2-(thiophen-2-ylsulfinylmethyl)pyridine (PubChem CID 56639480) has the molecular formula C10H9NOS2 and a molecular weight of 223.32 g/mol. Its IUPAC name is 2-(thiophen-2-ylsulfinylmethyl)pyridine.

Molecular Properties

Compound Name2-(thiophen-2-ylsulfinylmethyl)pyridine
PubChem CID56639480
Molecular FormulaC10H9NOS2
Molecular Weight223.32 g/mol
Exact Mass223.01
IUPAC Name2-(thiophen-2-ylsulfinylmethyl)pyridine
SMILESO=S(Cc1ccccn1)c1cccs1
InChIInChI=1S/C10H9NOS2/c12-14(10-5-3-7-13-10)8-9-4-1-2-6-11-9/h1-7H,8H2
InChIKeyPHUNWXSDBIRYMJ-UHFFFAOYSA-N
XLogP2.45
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-methylphenyl)sulfinylmethyl]pyridine
CID 14545769
pyridin-2-ylmethanesulfinate
CID 57191587
methyl 2-(thiophen-2-ylsulfinylmethyl)pyridine-3-carboxylate
CID 114198927
1-(pyridin-2-ylmethyl)-3-(thiophen-2-ylmethyl)urea
CID 47125825
4-chloro-3-(pyridin-2-ylmethylsulfinyl)aniline
CID 81201349
2-(pyridin-2-ylmethylsulfinyl)propanoic acid
CID 60982235
2-ethylpyridine;sulfurous acid
CID 174743952
[4-fluoro-2-(thiophen-2-ylsulfinylmethyl)phenyl]methanamine
CID 81329556
3-chloro-N-methyl-4-(pyridin-2-ylmethylsulfinyl)aniline
CID 19814401
5-fluoro-4-piperidin-1-yl-6-(thiophen-2-ylsulfinylmethyl)pyrimidine
CID 57061886
lithium pyridin-2-ylmethanethiolate
CID 20660763
2-[2-[(S)-methylsulfinyl]ethyl]pyridine
CID 97301952

Frequently Asked Questions

What is the IUPAC name of 2-(thiophen-2-ylsulfinylmethyl)pyridine?
The IUPAC name of 2-(thiophen-2-ylsulfinylmethyl)pyridine (CID 56639480) is 2-(thiophen-2-ylsulfinylmethyl)pyridine.
What is the SMILES notation for 2-(thiophen-2-ylsulfinylmethyl)pyridine?
The canonical SMILES for 2-(thiophen-2-ylsulfinylmethyl)pyridine is O=S(Cc1ccccn1)c1cccs1.
What is the InChIKey of 2-(thiophen-2-ylsulfinylmethyl)pyridine?
The InChIKey is PHUNWXSDBIRYMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NOS2/c12-14(10-5-3-7-13-10)8-9-4-1-2-6-11-9/h1-7H,8H2.
What are the key properties of 2-(thiophen-2-ylsulfinylmethyl)pyridine?
2-(thiophen-2-ylsulfinylmethyl)pyridine has a molecular weight of 223.32 g/mol, XLogP of 2.45, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(thiophen-2-ylsulfinylmethyl)pyridine is sourced from PubChem (CID 56639480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).