2-[(E)-2-pyridin-2-ylsulfinylethenyl]pyridine

C12H10N2OS — CID 139618858

IUPAC2-[(E)-2-pyridin-2-ylsulfinylethenyl]pyridine
SMILESO=S(/C=C/c1ccccn1)c1ccccn1
InChIInChI=1S/C12H10N2OS/c15-16(12-6-2-4-9-14-12)10-7-11-5-1-3-8-13-11/h1-10H/b10-7+
InChIKeyFKKNTGIMAPJJBO-JXMROGBWSA-N
MW230.29 g/mol
LogP2.26
Rot. Bonds3

About 2-[(E)-2-pyridin-2-ylsulfinylethenyl]pyridine

2-[(E)-2-pyridin-2-ylsulfinylethenyl]pyridine (PubChem CID 139618858) has the molecular formula C12H10N2OS and a molecular weight of 230.29 g/mol. Its IUPAC name is 2-[(E)-2-pyridin-2-ylsulfinylethenyl]pyridine.

Molecular Properties

Compound Name2-[(E)-2-pyridin-2-ylsulfinylethenyl]pyridine
PubChem CID139618858
Molecular FormulaC12H10N2OS
Molecular Weight230.29 g/mol
Exact Mass230.05
IUPAC Name2-[(E)-2-pyridin-2-ylsulfinylethenyl]pyridine
SMILESO=S(/C=C/c1ccccn1)c1ccccn1
InChIInChI=1S/C12H10N2OS/c15-16(12-6-2-4-9-14-12)10-7-11-5-1-3-8-13-11/h1-10H/b10-7+
InChIKeyFKKNTGIMAPJJBO-JXMROGBWSA-N
XLogP2.26
TPSA42.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.29
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,2'-Dipyridyl disulfide
CID 65093
2-Phenylthiopyridine
CID 817760
2-(Benzenesulfonyl)pyridine
CID 289829
2-(Methylsulfonyl)pyridine
CID 98667
2-{2-[(4-Fluorophenyl)sulfanyl]ethyl}pyridine
CID 761521
4,4'-Dipyridyl Sulfide
CID 604650
6-(Phenylsulfonyl)pyridine-3-sulfonamide
CID 819426
3-fluoro-2-[(E)-2-(3-fluorophenyl)sulfonylethenyl]pyridine
CID 146380834
3-fluoro-2-[(E)-2-(4-fluorophenyl)sulfonylethenyl]pyridine
CID 146381172
3-fluoro-2-[(E)-2-(2-fluorophenyl)sulfonylethenyl]pyridine
CID 146381173
Phenyl 2-pyridylmethyl sulfone
CID 3321062
2-Pyridinesulfonylacetonitrile
CID 519355

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-pyridin-2-ylsulfinylethenyl]pyridine?
The IUPAC name of 2-[(E)-2-pyridin-2-ylsulfinylethenyl]pyridine (CID 139618858) is 2-[(E)-2-pyridin-2-ylsulfinylethenyl]pyridine.
What is the SMILES notation for 2-[(E)-2-pyridin-2-ylsulfinylethenyl]pyridine?
The canonical SMILES for 2-[(E)-2-pyridin-2-ylsulfinylethenyl]pyridine is O=S(/C=C/c1ccccn1)c1ccccn1.
What is the InChIKey of 2-[(E)-2-pyridin-2-ylsulfinylethenyl]pyridine?
The InChIKey is FKKNTGIMAPJJBO-JXMROGBWSA-N. The full InChI is InChI=1S/C12H10N2OS/c15-16(12-6-2-4-9-14-12)10-7-11-5-1-3-8-13-11/h1-10H/b10-7+.
What are the key properties of 2-[(E)-2-pyridin-2-ylsulfinylethenyl]pyridine?
2-[(E)-2-pyridin-2-ylsulfinylethenyl]pyridine has a molecular weight of 230.29 g/mol, XLogP of 2.26, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-pyridin-2-ylsulfinylethenyl]pyridine is sourced from PubChem (CID 139618858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).