(3-methoxypyrazin-2-yl)-(3-methylfuran-2-yl)methanone

C11H10N2O3 — CID 104799708

IUPAC(3-methoxypyrazin-2-yl)-(3-methylfuran-2-yl)methanone
SMILESCOc1nccnc1C(=O)c1occc1C
InChIInChI=1S/C11H10N2O3/c1-7-3-6-16-10(7)9(14)8-11(15-2)13-5-4-12-8/h3-6H,1-2H3
InChIKeyCLROHGCVUDRISN-UHFFFAOYSA-N
MW218.21 g/mol
LogP1.62
Rot. Bonds3

About (3-methoxypyrazin-2-yl)-(3-methylfuran-2-yl)methanone

(3-methoxypyrazin-2-yl)-(3-methylfuran-2-yl)methanone (PubChem CID 104799708) has the molecular formula C11H10N2O3 and a molecular weight of 218.21 g/mol. Its IUPAC name is (3-methoxypyrazin-2-yl)-(3-methylfuran-2-yl)methanone.

Molecular Properties

Compound Name(3-methoxypyrazin-2-yl)-(3-methylfuran-2-yl)methanone
PubChem CID104799708
Molecular FormulaC11H10N2O3
Molecular Weight218.21 g/mol
Exact Mass218.07
IUPAC Name(3-methoxypyrazin-2-yl)-(3-methylfuran-2-yl)methanone
SMILESCOc1nccnc1C(=O)c1occc1C
InChIInChI=1S/C11H10N2O3/c1-7-3-6-16-10(7)9(14)8-11(15-2)13-5-4-12-8/h3-6H,1-2H3
InChIKeyCLROHGCVUDRISN-UHFFFAOYSA-N
XLogP1.62
TPSA65.22 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.21
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (3-methoxypyrazin-2-yl)-(3-methylfuran-2-yl)methanone?
The IUPAC name of (3-methoxypyrazin-2-yl)-(3-methylfuran-2-yl)methanone (CID 104799708) is (3-methoxypyrazin-2-yl)-(3-methylfuran-2-yl)methanone.
What is the SMILES notation for (3-methoxypyrazin-2-yl)-(3-methylfuran-2-yl)methanone?
The canonical SMILES for (3-methoxypyrazin-2-yl)-(3-methylfuran-2-yl)methanone is COc1nccnc1C(=O)c1occc1C.
What is the InChIKey of (3-methoxypyrazin-2-yl)-(3-methylfuran-2-yl)methanone?
The InChIKey is CLROHGCVUDRISN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O3/c1-7-3-6-16-10(7)9(14)8-11(15-2)13-5-4-12-8/h3-6H,1-2H3.
What are the key properties of (3-methoxypyrazin-2-yl)-(3-methylfuran-2-yl)methanone?
(3-methoxypyrazin-2-yl)-(3-methylfuran-2-yl)methanone has a molecular weight of 218.21 g/mol, XLogP of 1.62, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxypyrazin-2-yl)-(3-methylfuran-2-yl)methanone is sourced from PubChem (CID 104799708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).