(5E)-5-[(Z)-but-2-enylidene]-3-methyl-6-methylidene-1,3-diazinane-2,4-dione

C10H12N2O2 — CID 142210669

IUPAC(5E)-5-[(Z)-but-2-enylidene]-3-methyl-6-methylidene-1,3-diazinane-2,4-dione
SMILESC=c1[nH]c(=O)n(C)c(=O)/c1=C/C=C\C
InChIInChI=1S/C10H12N2O2/c1-4-5-6-8-7(2)11-10(14)12(3)9(8)13/h4-6H,2H2,1,3H3,(H,11,14)/b5-4-,8-6+
InChIKeyIFEWJKJZLAYKLW-GSGSLZOQSA-N
MW192.22 g/mol
LogP-1.16
Rot. Bonds1

About (5E)-5-[(Z)-but-2-enylidene]-3-methyl-6-methylidene-1,3-diazinane-2,4-dione

(5E)-5-[(Z)-but-2-enylidene]-3-methyl-6-methylidene-1,3-diazinane-2,4-dione (PubChem CID 142210669) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is (5E)-5-[(Z)-but-2-enylidene]-3-methyl-6-methylidene-1,3-diazinane-2,4-dione.

Molecular Properties

Compound Name(5E)-5-[(Z)-but-2-enylidene]-3-methyl-6-methylidene-1,3-diazinane-2,4-dione
PubChem CID142210669
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC Name(5E)-5-[(Z)-but-2-enylidene]-3-methyl-6-methylidene-1,3-diazinane-2,4-dione
SMILESC=c1[nH]c(=O)n(C)c(=O)/c1=C/C=C\C
InChIInChI=1S/C10H12N2O2/c1-4-5-6-8-7(2)11-10(14)12(3)9(8)13/h4-6H,2H2,1,3H3,(H,11,14)/b5-4-,8-6+
InChIKeyIFEWJKJZLAYKLW-GSGSLZOQSA-N
XLogP-1.16
TPSA54.86 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 5-1.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (5E)-5-[(Z)-but-2-enylidene]-3-methyl-6-methylidene-1,3-diazinane-2,4-dione with MolForge

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Related Compounds

(E)-N,N-dimethyl-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)prop-2-enamide
CID 919528
5-[(E)-3-(dimethylamino)prop-2-enylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
CID 6282221
(5Z)-1-methyl-5-(3-methylbut-2-enylidene)-1,3-diazinane-2,4,6-trione
CID 13895080
5-[3-(Dimethylamino)prop-2-enylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
CID 319881
1,3-Dimethyl-5,6-dimethylidene-1,3-diazinane-2,4-dione
CID 53902591
(5Z)-5-ethylidene-1,3-dimethyl-2,6-dimethylidene-1,3-diazinan-4-one
CID 59723653
3-Methyl-5,6-dimethylidene-1,3-diazinane-2,4-dione
CID 60116670
5-Ethylidene-3-methyl-6-methylidene-1-(2-methylpropyl)-1,3-diazinane-2,4-dione
CID 91265806
(5E,6E)-5-ethylidene-6-prop-2-enylidene-1,3-diazinane-2,4-dione
CID 122491490
3,6-dimethyl-6,7-dihydro-1H-quinazoline-2,4-dione
CID 123335704
5-But-2-enylidene-1-ethyl-1,3-diazinane-2,4,6-trione
CID 123410516
6-Ethylidene-5-prop-2-enylidene-1,3-diazinane-2,4-dione
CID 123624994

Frequently Asked Questions

What is the IUPAC name of (5E)-5-[(Z)-but-2-enylidene]-3-methyl-6-methylidene-1,3-diazinane-2,4-dione?
The IUPAC name of (5E)-5-[(Z)-but-2-enylidene]-3-methyl-6-methylidene-1,3-diazinane-2,4-dione (CID 142210669) is (5E)-5-[(Z)-but-2-enylidene]-3-methyl-6-methylidene-1,3-diazinane-2,4-dione.
What is the SMILES notation for (5E)-5-[(Z)-but-2-enylidene]-3-methyl-6-methylidene-1,3-diazinane-2,4-dione?
The canonical SMILES for (5E)-5-[(Z)-but-2-enylidene]-3-methyl-6-methylidene-1,3-diazinane-2,4-dione is C=c1[nH]c(=O)n(C)c(=O)/c1=C/C=C\C.
What is the InChIKey of (5E)-5-[(Z)-but-2-enylidene]-3-methyl-6-methylidene-1,3-diazinane-2,4-dione?
The InChIKey is IFEWJKJZLAYKLW-GSGSLZOQSA-N. The full InChI is InChI=1S/C10H12N2O2/c1-4-5-6-8-7(2)11-10(14)12(3)9(8)13/h4-6H,2H2,1,3H3,(H,11,14)/b5-4-,8-6+.
What are the key properties of (5E)-5-[(Z)-but-2-enylidene]-3-methyl-6-methylidene-1,3-diazinane-2,4-dione?
(5E)-5-[(Z)-but-2-enylidene]-3-methyl-6-methylidene-1,3-diazinane-2,4-dione has a molecular weight of 192.22 g/mol, XLogP of -1.16, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-5-[(Z)-but-2-enylidene]-3-methyl-6-methylidene-1,3-diazinane-2,4-dione is sourced from PubChem (CID 142210669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).