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

C10H12N2O3 — CID 104514950

IUPAC(3-methoxypyrazin-2-yl)-(oxolan-2-yl)methanone
SMILESCOc1nccnc1C(=O)C1CCCO1
InChIInChI=1S/C10H12N2O3/c1-14-10-8(11-4-5-12-10)9(13)7-3-2-6-15-7/h4-5,7H,2-3,6H2,1H3
InChIKeyHZDPZEXLHJEOQK-UHFFFAOYSA-N
MW208.22 g/mol
LogP0.85
Rot. Bonds3

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

(3-methoxypyrazin-2-yl)-(oxolan-2-yl)methanone (PubChem CID 104514950) has the molecular formula C10H12N2O3 and a molecular weight of 208.22 g/mol. Its IUPAC name is (3-methoxypyrazin-2-yl)-(oxolan-2-yl)methanone.

Molecular Properties

Compound Name(3-methoxypyrazin-2-yl)-(oxolan-2-yl)methanone
PubChem CID104514950
Molecular FormulaC10H12N2O3
Molecular Weight208.22 g/mol
Exact Mass208.08
IUPAC Name(3-methoxypyrazin-2-yl)-(oxolan-2-yl)methanone
SMILESCOc1nccnc1C(=O)C1CCCO1
InChIInChI=1S/C10H12N2O3/c1-14-10-8(11-4-5-12-10)9(13)7-3-2-6-15-7/h4-5,7H,2-3,6H2,1H3
InChIKeyHZDPZEXLHJEOQK-UHFFFAOYSA-N
XLogP0.85
TPSA61.31 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 50.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-bicyclo[3.1.0]hexanyl-(3-methoxypyrazin-2-yl)methanone
CID 115797296
(3-methoxypyrazin-2-yl)-(oxolan-3-yl)methanone
CID 104514951
(3-methoxypyrazin-2-yl)-[2-(trifluoromethyl)cyclohexyl]methanone
CID 105126821
(3-methoxypyrazin-2-yl)-[4-(methylamino)oxolan-3-yl]methanone
CID 116561358
(4-methoxyphenyl)-(oxan-2-yl)methanone
CID 62212790
3-methoxypyrazine-2-carboxamide
CID 12571039
(4-butylcyclohexyl)-(3-methoxypyrazin-2-yl)methanone
CID 115796981
3-[[(2R)-oxolane-2-carbonyl]amino]pyrazine-2-carboxylic acid
CID 104855685
1-(3-methoxypyrazin-2-yl)butane-1,3-dione
CID 55262325
(3-methoxypyrazin-2-yl)-(1-methylcyclopropyl)methanone
CID 104515026
(2S)-N-(6-methoxy-3-pyridinyl)oxolane-2-carboxamide
CID 34666491
1-adamantyl-(3-methoxypyrazin-2-yl)methanone
CID 104514904

Frequently Asked Questions

What is the IUPAC name of (3-methoxypyrazin-2-yl)-(oxolan-2-yl)methanone?
The IUPAC name of (3-methoxypyrazin-2-yl)-(oxolan-2-yl)methanone (CID 104514950) is (3-methoxypyrazin-2-yl)-(oxolan-2-yl)methanone.
What is the SMILES notation for (3-methoxypyrazin-2-yl)-(oxolan-2-yl)methanone?
The canonical SMILES for (3-methoxypyrazin-2-yl)-(oxolan-2-yl)methanone is COc1nccnc1C(=O)C1CCCO1.
What is the InChIKey of (3-methoxypyrazin-2-yl)-(oxolan-2-yl)methanone?
The InChIKey is HZDPZEXLHJEOQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O3/c1-14-10-8(11-4-5-12-10)9(13)7-3-2-6-15-7/h4-5,7H,2-3,6H2,1H3.
What are the key properties of (3-methoxypyrazin-2-yl)-(oxolan-2-yl)methanone?
(3-methoxypyrazin-2-yl)-(oxolan-2-yl)methanone has a molecular weight of 208.22 g/mol, XLogP of 0.85, 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)-(oxolan-2-yl)methanone is sourced from PubChem (CID 104514950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).