ethane;(4E)-3-ethenyl-4-prop-2-enylidene-2H-pyrrolo[3,4-c]pyridine-1,6-dione

C14H16N2O2 — CID 143468913

IUPACethane;(4E)-3-ethenyl-4-prop-2-enylidene-2H-pyrrolo[3,4-c]pyridine-1,6-dione
SMILESC=C/C=c1/[nH]c(=O)cc2c1=C(C=C)NC2=O.CC
InChIInChI=1S/C12H10N2O2.C2H6/c1-3-5-9-11-7(6-10(15)13-9)12(16)14-8(11)4-2;1-2/h3-6H,1-2H2,(H,13,15)(H,14,16);1-2H3/b9-5+;
InChIKeyQOJDVWMCZCBHFZ-SZKNIZGXSA-N
MW244.29 g/mol
LogP0.41
Rot. Bonds2

About ethane;(4E)-3-ethenyl-4-prop-2-enylidene-2H-pyrrolo[3,4-c]pyridine-1,6-dione

ethane;(4E)-3-ethenyl-4-prop-2-enylidene-2H-pyrrolo[3,4-c]pyridine-1,6-dione (PubChem CID 143468913) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is ethane;(4E)-3-ethenyl-4-prop-2-enylidene-2H-pyrrolo[3,4-c]pyridine-1,6-dione.

Molecular Properties

Compound Nameethane;(4E)-3-ethenyl-4-prop-2-enylidene-2H-pyrrolo[3,4-c]pyridine-1,6-dione
PubChem CID143468913
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Nameethane;(4E)-3-ethenyl-4-prop-2-enylidene-2H-pyrrolo[3,4-c]pyridine-1,6-dione
SMILESC=C/C=c1/[nH]c(=O)cc2c1=C(C=C)NC2=O.CC
InChIInChI=1S/C12H10N2O2.C2H6/c1-3-5-9-11-7(6-10(15)13-9)12(16)14-8(11)4-2;1-2/h3-6H,1-2H2,(H,13,15)(H,14,16);1-2H3/b9-5+;
InChIKeyQOJDVWMCZCBHFZ-SZKNIZGXSA-N
XLogP0.41
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze ethane;(4E)-3-ethenyl-4-prop-2-enylidene-2H-pyrrolo[3,4-c]pyridine-1,6-dione with MolForge

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Related Compounds

3-Methyl-6-propyl-1h-pyridin-2-one
CID 12354332
3-ethyl-6-methyl-1H-pyridin-2-one
CID 2797876
3,6-dipropyl-1H-pyridin-2-one
CID 12354333
6-But-3-enyl-2-hydroxynicotinamide
CID 11074241
6-Butyl-4-carbamoyl-2-oxo-1,2-dihydropyridine
CID 18960818
3-Ethyl-4-methyl-2,7-dihydrocyclopenta[c]pyridin-1-one
CID 20720242
3-ethyl-6-propan-2-yl-1H-pyridin-2-one
CID 20774831
2-oxo-6-propyl-1H-pyridine-4-carboxamide
CID 23352068
N-cyclopenta-1,3-dien-1-ylcyclopenta-1,3-diene-1-carboxamide
CID 59861895
N-[2-(butanoylamino)cyclohexa-1,3-dien-1-yl]butanamide
CID 66796008
1,4-Dihydroindol-2-one
CID 67469329
2-oxo-6-propyl-1H-pyridine-3-carboxamide
CID 67499518

Frequently Asked Questions

What is the IUPAC name of ethane;(4E)-3-ethenyl-4-prop-2-enylidene-2H-pyrrolo[3,4-c]pyridine-1,6-dione?
The IUPAC name of ethane;(4E)-3-ethenyl-4-prop-2-enylidene-2H-pyrrolo[3,4-c]pyridine-1,6-dione (CID 143468913) is ethane;(4E)-3-ethenyl-4-prop-2-enylidene-2H-pyrrolo[3,4-c]pyridine-1,6-dione.
What is the SMILES notation for ethane;(4E)-3-ethenyl-4-prop-2-enylidene-2H-pyrrolo[3,4-c]pyridine-1,6-dione?
The canonical SMILES for ethane;(4E)-3-ethenyl-4-prop-2-enylidene-2H-pyrrolo[3,4-c]pyridine-1,6-dione is C=C/C=c1/[nH]c(=O)cc2c1=C(C=C)NC2=O.CC.
What is the InChIKey of ethane;(4E)-3-ethenyl-4-prop-2-enylidene-2H-pyrrolo[3,4-c]pyridine-1,6-dione?
The InChIKey is QOJDVWMCZCBHFZ-SZKNIZGXSA-N. The full InChI is InChI=1S/C12H10N2O2.C2H6/c1-3-5-9-11-7(6-10(15)13-9)12(16)14-8(11)4-2;1-2/h3-6H,1-2H2,(H,13,15)(H,14,16);1-2H3/b9-5+;.
What are the key properties of ethane;(4E)-3-ethenyl-4-prop-2-enylidene-2H-pyrrolo[3,4-c]pyridine-1,6-dione?
ethane;(4E)-3-ethenyl-4-prop-2-enylidene-2H-pyrrolo[3,4-c]pyridine-1,6-dione has a molecular weight of 244.29 g/mol, XLogP of 0.41, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(4E)-3-ethenyl-4-prop-2-enylidene-2H-pyrrolo[3,4-c]pyridine-1,6-dione is sourced from PubChem (CID 143468913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).