(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,3-oxazolidine

C8H11NO — CID 162723403

IUPAC(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,3-oxazolidine
SMILESC=C(C)/C=C1/OCNC1=C
InChIInChI=1S/C8H11NO/c1-6(2)4-8-7(3)9-5-10-8/h4,9H,1,3,5H2,2H3/b8-4+
InChIKeyOPBOOZWVIZDEQU-XBXARRHUSA-N
MW137.18 g/mol
LogP1.54
Rot. Bonds1

About (5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,3-oxazolidine

(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,3-oxazolidine (PubChem CID 162723403) has the molecular formula C8H11NO and a molecular weight of 137.18 g/mol. Its IUPAC name is (5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,3-oxazolidine.

Molecular Properties

Compound Name(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,3-oxazolidine
PubChem CID162723403
Molecular FormulaC8H11NO
Molecular Weight137.18 g/mol
Exact Mass137.08
IUPAC Name(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,3-oxazolidine
SMILESC=C(C)/C=C1/OCNC1=C
InChIInChI=1S/C8H11NO/c1-6(2)4-8-7(3)9-5-10-8/h4,9H,1,3,5H2,2H3/b8-4+
InChIKeyOPBOOZWVIZDEQU-XBXARRHUSA-N
XLogP1.54
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.18
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,3-oxazolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(5E)-2,2-difluoro-5-[(Z)-2-methylbut-2-enylidene]-4-methylidene-1,3-oxazolidine
CID 142839542
(3E,5Z)-3-methoxy-N,5-dimethylhepta-1,3,5-trien-2-amine
CID 137427656
5,5-Dimethyl-2,3-dihydrocyclohepta[d][1,3]oxazole
CID 138722222
ethane;(4E,5E)-4-ethylidene-5-propylidene-1,3-oxazolidine
CID 142300254
ethane;7-methoxy-N,4-dimethylcyclohepta-1,4,6-trien-1-amine
CID 142474982
ethane;5-methyl-3,7-dihydro-2H-cyclohepta[d][1,3]oxazole
CID 143256258
ethane;(4E)-5-methylidene-4-(2-methylprop-2-enylidene)-1,3-oxazolidine
CID 143256828
ethane;(4E,5E)-5-ethylidene-4-prop-2-enylidene-1,3-oxazolidine
CID 143817261
ethane;(4E,5E)-4-ethylidene-5-prop-2-enylidene-1,3-oxazolidine
CID 144877979
Ethane;2,3,5,6-tetrahydro-1,3-benzoxazole
CID 145267149
2,3,5,6-Tetrahydro-1,3-benzoxazole
CID 145267150
ethane;(3E)-2-methoxy-N,5-dimethylhexa-1,3,5-trien-3-amine
CID 163229690

Frequently Asked Questions

What is the IUPAC name of (5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,3-oxazolidine?
The IUPAC name of (5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,3-oxazolidine (CID 162723403) is (5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,3-oxazolidine.
What is the SMILES notation for (5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,3-oxazolidine?
The canonical SMILES for (5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,3-oxazolidine is C=C(C)/C=C1/OCNC1=C.
What is the InChIKey of (5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,3-oxazolidine?
The InChIKey is OPBOOZWVIZDEQU-XBXARRHUSA-N. The full InChI is InChI=1S/C8H11NO/c1-6(2)4-8-7(3)9-5-10-8/h4,9H,1,3,5H2,2H3/b8-4+.
What are the key properties of (5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,3-oxazolidine?
(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,3-oxazolidine has a molecular weight of 137.18 g/mol, XLogP of 1.54, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,3-oxazolidine is sourced from PubChem (CID 162723403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).