2,4-dihydro-1H-furo[3,4-b]pyrazin-3-one

C6H6N2O2 — CID 92546001

IUPAC2,4-dihydro-1H-furo[3,4-b]pyrazin-3-one
SMILESO=C1CNc2cocc2N1
InChIInChI=1S/C6H6N2O2/c9-6-1-7-4-2-10-3-5(4)8-6/h2-3,7H,1H2,(H,8,9)
InChIKeyDEUKQWLCHXRPKQ-UHFFFAOYSA-N
MW138.13 g/mol
LogP0.64
Rot. Bonds

About 2,4-dihydro-1H-furo[3,4-b]pyrazin-3-one

2,4-dihydro-1H-furo[3,4-b]pyrazin-3-one (PubChem CID 92546001) has the molecular formula C6H6N2O2 and a molecular weight of 138.13 g/mol. Its IUPAC name is 2,4-dihydro-1H-furo[3,4-b]pyrazin-3-one.

Molecular Properties

Compound Name2,4-dihydro-1H-furo[3,4-b]pyrazin-3-one
PubChem CID92546001
Molecular FormulaC6H6N2O2
Molecular Weight138.13 g/mol
Exact Mass138.04
IUPAC Name2,4-dihydro-1H-furo[3,4-b]pyrazin-3-one
SMILESO=C1CNc2cocc2N1
InChIInChI=1S/C6H6N2O2/c9-6-1-7-4-2-10-3-5(4)8-6/h2-3,7H,1H2,(H,8,9)
InChIKeyDEUKQWLCHXRPKQ-UHFFFAOYSA-N
XLogP0.64
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.13
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-N,4-N-dimethylfuran-3,4-diamine
CID 21099945
N'-(furan-3-yl)ethane-1,2-diamine
CID 59116159
1-(Furan-3-yl)piperazine
CID 63948938
(4-Aminofuran-3-yl)carbamic acid
CID 66872728
1,2,3,4-Tetrahydrofuro[2,3-b]pyrazine
CID 67258053
1-(Furan-3-yl)-2-methylpiperazine
CID 70574891
N-[4-(dimethylamino)furan-3-yl]-N-methylacetamide
CID 89778196
1-(Furan-3-yl)piperazin-2-one
CID 131062759
1-(Furan-3-yl)piperazine;hydrochloride
CID 139391252
3-N,3-N-dimethylfuran-3,4-diamine
CID 140081880
Ethane;1-(furan-3-yl)piperazine;methoxyethane
CID 142245666
ethane;N-methyl-N-[4-(methylamino)furan-3-yl]prop-2-enamide
CID 144268433

Frequently Asked Questions

What is the IUPAC name of 2,4-dihydro-1H-furo[3,4-b]pyrazin-3-one?
The IUPAC name of 2,4-dihydro-1H-furo[3,4-b]pyrazin-3-one (CID 92546001) is 2,4-dihydro-1H-furo[3,4-b]pyrazin-3-one.
What is the SMILES notation for 2,4-dihydro-1H-furo[3,4-b]pyrazin-3-one?
The canonical SMILES for 2,4-dihydro-1H-furo[3,4-b]pyrazin-3-one is O=C1CNc2cocc2N1.
What is the InChIKey of 2,4-dihydro-1H-furo[3,4-b]pyrazin-3-one?
The InChIKey is DEUKQWLCHXRPKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N2O2/c9-6-1-7-4-2-10-3-5(4)8-6/h2-3,7H,1H2,(H,8,9).
What are the key properties of 2,4-dihydro-1H-furo[3,4-b]pyrazin-3-one?
2,4-dihydro-1H-furo[3,4-b]pyrazin-3-one has a molecular weight of 138.13 g/mol, XLogP of 0.64, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dihydro-1H-furo[3,4-b]pyrazin-3-one is sourced from PubChem (CID 92546001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).