2-[(Z)-3H-2-benzofuran-1-ylidenemethyl]pyrazine

C13H10N2O — CID 12063893

IUPAC2-[(Z)-3H-2-benzofuran-1-ylidenemethyl]pyrazine
SMILESC(=C1\OCc2ccccc21)\c1cnccn1
InChIInChI=1S/C13H10N2O/c1-2-4-12-10(3-1)9-16-13(12)7-11-8-14-5-6-15-11/h1-8H,9H2/b13-7-
InChIKeyQNAHGIVJBIYHNU-QPEQYQDCSA-N
MW210.24 g/mol
LogP2.50
Rot. Bonds1

About 2-[(Z)-3H-2-benzofuran-1-ylidenemethyl]pyrazine

2-[(Z)-3H-2-benzofuran-1-ylidenemethyl]pyrazine (PubChem CID 12063893) has the molecular formula C13H10N2O and a molecular weight of 210.24 g/mol. Its IUPAC name is 2-[(Z)-3H-2-benzofuran-1-ylidenemethyl]pyrazine.

Molecular Properties

Compound Name2-[(Z)-3H-2-benzofuran-1-ylidenemethyl]pyrazine
PubChem CID12063893
Molecular FormulaC13H10N2O
Molecular Weight210.24 g/mol
Exact Mass210.08
IUPAC Name2-[(Z)-3H-2-benzofuran-1-ylidenemethyl]pyrazine
SMILESC(=C1\OCc2ccccc21)\c1cnccn1
InChIInChI=1S/C13H10N2O/c1-2-4-12-10(3-1)9-16-13(12)7-11-8-14-5-6-15-11/h1-8H,9H2/b13-7-
InChIKeyQNAHGIVJBIYHNU-QPEQYQDCSA-N
XLogP2.50
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(E)-2-(2-methoxyphenyl)ethenyl]pyrazine
CID 5929728
2-Methyl-6-[(2-methylphenyl)methoxy]pyrazine
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2-(difluoromethyl)-6-(4-methyl-1-methylidene-3H-2-benzofuran-5-yl)pyrazine
CID 166906093
(z)-2-(3h-Isobenzofuran-1ylidenemethyl)-pyridine
CID 12063892
(Z)-1-phenyl-2-pyrazin-2-ylethenol
CID 135706786
2-[2-(2-Methoxyphenyl)ethenyl]pyrazine
CID 300938
2-[2-[2-(2-Ethoxyethyl)phenyl]ethenyl]pyrazine
CID 53633982
(3Z)-3-(3H-2-benzofuran-1-ylidene)-1,2-dihydropyrrolo[3,2-b]pyridine
CID 59665585
3-(3H-2-benzofuran-1-ylidene)-1,2-dihydropyrrolo[3,2-b]pyridine
CID 72351886
Z-3-[3-(pyridin-3-yl)propylidene]isobenzofuran
CID 86600090
N-(2-methoxy-2-phenylethyl)-1-pyrazin-2-ylmethanimine
CID 90457293
N-(2-methoxy-2-phenylethyl)-1-(5-methylpyrazin-2-yl)methanimine
CID 90459010

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-3H-2-benzofuran-1-ylidenemethyl]pyrazine?
The IUPAC name of 2-[(Z)-3H-2-benzofuran-1-ylidenemethyl]pyrazine (CID 12063893) is 2-[(Z)-3H-2-benzofuran-1-ylidenemethyl]pyrazine.
What is the SMILES notation for 2-[(Z)-3H-2-benzofuran-1-ylidenemethyl]pyrazine?
The canonical SMILES for 2-[(Z)-3H-2-benzofuran-1-ylidenemethyl]pyrazine is C(=C1\OCc2ccccc21)\c1cnccn1.
What is the InChIKey of 2-[(Z)-3H-2-benzofuran-1-ylidenemethyl]pyrazine?
The InChIKey is QNAHGIVJBIYHNU-QPEQYQDCSA-N. The full InChI is InChI=1S/C13H10N2O/c1-2-4-12-10(3-1)9-16-13(12)7-11-8-14-5-6-15-11/h1-8H,9H2/b13-7-.
What are the key properties of 2-[(Z)-3H-2-benzofuran-1-ylidenemethyl]pyrazine?
2-[(Z)-3H-2-benzofuran-1-ylidenemethyl]pyrazine has a molecular weight of 210.24 g/mol, XLogP of 2.50, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-3H-2-benzofuran-1-ylidenemethyl]pyrazine is sourced from PubChem (CID 12063893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).