ethane;(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,2-oxazole

C10H15NO — CID 143383188

IUPACethane;(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,2-oxazole
SMILESC=C(C)/C=c1/oncc1=C.CC
InChIInChI=1S/C8H9NO.C2H6/c1-6(2)4-8-7(3)5-9-10-8;1-2/h4-5H,1,3H2,2H3;1-2H3/b8-4+;
InChIKeyCAMJISBYMUAYLU-ZFXMFRGYSA-N
MW165.24 g/mol
LogP1.47
Rot. Bonds1

About ethane;(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,2-oxazole

ethane;(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,2-oxazole (PubChem CID 143383188) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is ethane;(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,2-oxazole.

Molecular Properties

Compound Nameethane;(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,2-oxazole
PubChem CID143383188
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Nameethane;(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,2-oxazole
SMILESC=C(C)/C=c1/oncc1=C.CC
InChIInChI=1S/C8H9NO.C2H6/c1-6(2)4-8-7(3)5-9-10-8;1-2/h4-5H,1,3H2,2H3;1-2H3/b8-4+;
InChIKeyCAMJISBYMUAYLU-ZFXMFRGYSA-N
XLogP1.47
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4Z)-4-(2-fluoropent-1-en-3-ylidene)-5-methylidene-1,2-oxazole
CID 156867718
(z)-4-Methylene-5-propylidene-2-oxazolidine
CID 129708989
(5E)-5-(2-fluoroprop-2-enylidene)-4-methylidene-1,2-oxazole
CID 156867694
(5E)-5-(3-fluorobut-3-en-2-ylidene)-4-methylidene-1,2-oxazole
CID 156867733
4,5-Di(propan-2-ylidene)-1,2-oxazole
CID 57564396
4-Methyl-5,6-dihydro-1,2-benzoxazole
CID 68285165
(E,3Z,5Z)-N-ethoxy-2-methylidenehepta-3,5-dien-1-imine
CID 89197940
7H-cyclohepta[d][1,2]oxazole
CID 90957562
7-methyl-7H-cyclohepta[d][1,2]oxazole
CID 123808995
(4Z,5E)-5-ethylidene-4-prop-2-enylidene-1,2-oxazole
CID 138518868
(4Z,5E)-4,5-bis(prop-2-enylidene)-1,2-oxazole
CID 142219564
5H-cyclohepta[d][1,2]oxazole;ethane
CID 142873810

Frequently Asked Questions

What is the IUPAC name of ethane;(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,2-oxazole?
The IUPAC name of ethane;(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,2-oxazole (CID 143383188) is ethane;(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,2-oxazole.
What is the SMILES notation for ethane;(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,2-oxazole?
The canonical SMILES for ethane;(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,2-oxazole is C=C(C)/C=c1/oncc1=C.CC.
What is the InChIKey of ethane;(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,2-oxazole?
The InChIKey is CAMJISBYMUAYLU-ZFXMFRGYSA-N. The full InChI is InChI=1S/C8H9NO.C2H6/c1-6(2)4-8-7(3)5-9-10-8;1-2/h4-5H,1,3H2,2H3;1-2H3/b8-4+;.
What are the key properties of ethane;(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,2-oxazole?
ethane;(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,2-oxazole has a molecular weight of 165.24 g/mol, XLogP of 1.47, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(5E)-4-methylidene-5-(2-methylprop-2-enylidene)-1,2-oxazole is sourced from PubChem (CID 143383188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).