ethane;(6E)-5-methylidene-6-(2-methylprop-2-enylidene)pyrazin-2-one

C11H16N2O — CID 143759956

IUPACethane;(6E)-5-methylidene-6-(2-methylprop-2-enylidene)pyrazin-2-one
SMILESC=C(C)/C=c1/[nH]c(=O)cnc1=C.CC
InChIInChI=1S/C9H10N2O.C2H6/c1-6(2)4-8-7(3)10-5-9(12)11-8;1-2/h4-5H,1,3H2,2H3,(H,11,12);1-2H3/b8-4+;
InChIKeyCVHXKQQAVXIDEL-ZFXMFRGYSA-N
MW192.26 g/mol
LogP0.56
Rot. Bonds1

About ethane;(6E)-5-methylidene-6-(2-methylprop-2-enylidene)pyrazin-2-one

ethane;(6E)-5-methylidene-6-(2-methylprop-2-enylidene)pyrazin-2-one (PubChem CID 143759956) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is ethane;(6E)-5-methylidene-6-(2-methylprop-2-enylidene)pyrazin-2-one.

Molecular Properties

Compound Nameethane;(6E)-5-methylidene-6-(2-methylprop-2-enylidene)pyrazin-2-one
PubChem CID143759956
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Nameethane;(6E)-5-methylidene-6-(2-methylprop-2-enylidene)pyrazin-2-one
SMILESC=C(C)/C=c1/[nH]c(=O)cnc1=C.CC
InChIInChI=1S/C9H10N2O.C2H6/c1-6(2)4-8-7(3)10-5-9(12)11-8;1-2/h4-5H,1,3H2,2H3,(H,11,12);1-2H3/b8-4+;
InChIKeyCVHXKQQAVXIDEL-ZFXMFRGYSA-N
XLogP0.56
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1,5-dimethyl-2H-pyridin-3-yl)acetamide
CID 57076374
N-(1,5-diethyl-2H-pyridin-3-yl)acetamide
CID 57310396
N-(3-ethylcyclohexa-1,3-dien-1-yl)-3,4-dihydropyridine-6-carboxamide
CID 123154970
ethane;(5E)-5-ethylidene-6-propan-2-ylidenepyrazin-2-one
CID 141779819
6-methyl-8,8a-dihydro-1H-quinoxalin-2-one
CID 141779835
ethane;(5E,6E)-6-ethylidene-5-prop-2-enylidenepyrazin-2-one
CID 142957645
(E)-2-[(E)-(3-methylidene-5-oxopyrazin-2-ylidene)methyl]but-2-enenitrile
CID 143421482
(5E,6E)-5-[(Z)-but-2-enylidene]-6-prop-2-enylidenepyrazin-2-one
CID 143602463
Ethane;7-methyl-4,8-dihydrocyclohepta[b]pyrazin-3-one
CID 143807041
6,7-dihydro-1H-quinoxalin-2-one
CID 144083971
(5E)-5-[(Z)-but-2-enylidene]-6-methylidenepyrazin-2-one
CID 144204930
ethane;(2E)-2-hydroxyimino-N-(6-methylcyclohexa-1,5-dien-1-yl)acetamide
CID 144286027

Frequently Asked Questions

What is the IUPAC name of ethane;(6E)-5-methylidene-6-(2-methylprop-2-enylidene)pyrazin-2-one?
The IUPAC name of ethane;(6E)-5-methylidene-6-(2-methylprop-2-enylidene)pyrazin-2-one (CID 143759956) is ethane;(6E)-5-methylidene-6-(2-methylprop-2-enylidene)pyrazin-2-one.
What is the SMILES notation for ethane;(6E)-5-methylidene-6-(2-methylprop-2-enylidene)pyrazin-2-one?
The canonical SMILES for ethane;(6E)-5-methylidene-6-(2-methylprop-2-enylidene)pyrazin-2-one is C=C(C)/C=c1/[nH]c(=O)cnc1=C.CC.
What is the InChIKey of ethane;(6E)-5-methylidene-6-(2-methylprop-2-enylidene)pyrazin-2-one?
The InChIKey is CVHXKQQAVXIDEL-ZFXMFRGYSA-N. The full InChI is InChI=1S/C9H10N2O.C2H6/c1-6(2)4-8-7(3)10-5-9(12)11-8;1-2/h4-5H,1,3H2,2H3,(H,11,12);1-2H3/b8-4+;.
What are the key properties of ethane;(6E)-5-methylidene-6-(2-methylprop-2-enylidene)pyrazin-2-one?
ethane;(6E)-5-methylidene-6-(2-methylprop-2-enylidene)pyrazin-2-one has a molecular weight of 192.26 g/mol, XLogP of 0.56, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(6E)-5-methylidene-6-(2-methylprop-2-enylidene)pyrazin-2-one is sourced from PubChem (CID 143759956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).