(4E,5E)-3-methyl-2-methylidene-4,5-bis(prop-2-enylidene)-1,3-oxazolidine

C11H13NO — CID 139406343

IUPAC(4E,5E)-3-methyl-2-methylidene-4,5-bis(prop-2-enylidene)-1,3-oxazolidine
SMILESC=C/C=C1/OC(=C)N(C)/C1=C/C=C
InChIInChI=1S/C11H13NO/c1-5-7-10-11(8-6-2)13-9(3)12(10)4/h5-8H,1-3H2,4H3/b10-7+,11-8+
InChIKeyAZWIUFBTFAGCRX-AMMQDNIMSA-N
MW175.23 g/mol
LogP2.56
Rot. Bonds2

About (4E,5E)-3-methyl-2-methylidene-4,5-bis(prop-2-enylidene)-1,3-oxazolidine

(4E,5E)-3-methyl-2-methylidene-4,5-bis(prop-2-enylidene)-1,3-oxazolidine (PubChem CID 139406343) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is (4E,5E)-3-methyl-2-methylidene-4,5-bis(prop-2-enylidene)-1,3-oxazolidine.

Molecular Properties

Compound Name(4E,5E)-3-methyl-2-methylidene-4,5-bis(prop-2-enylidene)-1,3-oxazolidine
PubChem CID139406343
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC Name(4E,5E)-3-methyl-2-methylidene-4,5-bis(prop-2-enylidene)-1,3-oxazolidine
SMILESC=C/C=C1/OC(=C)N(C)/C1=C/C=C
InChIInChI=1S/C11H13NO/c1-5-7-10-11(8-6-2)13-9(3)12(10)4/h5-8H,1-3H2,4H3/b10-7+,11-8+
InChIKeyAZWIUFBTFAGCRX-AMMQDNIMSA-N
XLogP2.56
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4E,5E)-3-methyl-2-methylidene-4,5-bis(prop-2-enylidene)-1,3-oxazolidine?
The IUPAC name of (4E,5E)-3-methyl-2-methylidene-4,5-bis(prop-2-enylidene)-1,3-oxazolidine (CID 139406343) is (4E,5E)-3-methyl-2-methylidene-4,5-bis(prop-2-enylidene)-1,3-oxazolidine.
What is the SMILES notation for (4E,5E)-3-methyl-2-methylidene-4,5-bis(prop-2-enylidene)-1,3-oxazolidine?
The canonical SMILES for (4E,5E)-3-methyl-2-methylidene-4,5-bis(prop-2-enylidene)-1,3-oxazolidine is C=C/C=C1/OC(=C)N(C)/C1=C/C=C.
What is the InChIKey of (4E,5E)-3-methyl-2-methylidene-4,5-bis(prop-2-enylidene)-1,3-oxazolidine?
The InChIKey is AZWIUFBTFAGCRX-AMMQDNIMSA-N. The full InChI is InChI=1S/C11H13NO/c1-5-7-10-11(8-6-2)13-9(3)12(10)4/h5-8H,1-3H2,4H3/b10-7+,11-8+.
What are the key properties of (4E,5E)-3-methyl-2-methylidene-4,5-bis(prop-2-enylidene)-1,3-oxazolidine?
(4E,5E)-3-methyl-2-methylidene-4,5-bis(prop-2-enylidene)-1,3-oxazolidine has a molecular weight of 175.23 g/mol, XLogP of 2.56, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4E,5E)-3-methyl-2-methylidene-4,5-bis(prop-2-enylidene)-1,3-oxazolidine is sourced from PubChem (CID 139406343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).