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

C10H15NO — CID 155347226

IUPAC(4E)-2-methyl-4-(3-methylbut-2-enylidene)-5-methylidene-1,3-oxazolidine
SMILESC=C1OC(C)N/C1=C/C=C(C)C
InChIInChI=1S/C10H15NO/c1-7(2)5-6-10-8(3)12-9(4)11-10/h5-6,9,11H,3H2,1-2,4H3/b10-6+
InChIKeyOCLQUPMBZMLKIT-UXBLZVDNSA-N
MW165.24 g/mol
LogP2.32
Rot. Bonds1

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

(4E)-2-methyl-4-(3-methylbut-2-enylidene)-5-methylidene-1,3-oxazolidine (PubChem CID 155347226) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is (4E)-2-methyl-4-(3-methylbut-2-enylidene)-5-methylidene-1,3-oxazolidine.

Molecular Properties

Compound Name(4E)-2-methyl-4-(3-methylbut-2-enylidene)-5-methylidene-1,3-oxazolidine
PubChem CID155347226
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name(4E)-2-methyl-4-(3-methylbut-2-enylidene)-5-methylidene-1,3-oxazolidine
SMILESC=C1OC(C)N/C1=C/C=C(C)C
InChIInChI=1S/C10H15NO/c1-7(2)5-6-10-8(3)12-9(4)11-10/h5-6,9,11H,3H2,1-2,4H3/b10-6+
InChIKeyOCLQUPMBZMLKIT-UXBLZVDNSA-N
XLogP2.32
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(3-Methyl-1,2-dihydropyridin-6-yl)-2,3-dihydro-1,3-oxazole
CID 90464528
5-methyl-6-(2-methylprop-1-enyl)-3,4-dihydro-2H-1,4-oxazine
CID 117949988
ethane;(4E,5E)-4-ethylidene-2-methyl-5-prop-2-enylidene-1,3-oxazolidine
CID 142971050
(5Z,7Z)-2-methyl-2,3-dihydrocycloocta[d][1,3]oxazole
CID 173959728
4-Methyl-2-(2-methylprop-1-enyl)-1,3-oxazolidine
CID 175534238
(4E,5E)-4-ethylidene-2-methyl-5-prop-2-enylidene-1,3-oxazolidine
CID 142971051
(4E)-5-methylidene-4-(2-methylprop-2-enylidene)-1,3-oxazolidine
CID 143256829
(4E,5E)-5-ethylidene-4-prop-2-enylidene-1,3-oxazolidine
CID 143817262
(4E,5E)-4-ethylidene-5-prop-2-enylidene-1,3-oxazolidine
CID 144877980
(3aE,5Z,9E)-2-methyl-2,3,7,8-tetrahydrocycloocta[d][1,3]oxazole
CID 145200827

Frequently Asked Questions

What is the IUPAC name of (4E)-2-methyl-4-(3-methylbut-2-enylidene)-5-methylidene-1,3-oxazolidine?
The IUPAC name of (4E)-2-methyl-4-(3-methylbut-2-enylidene)-5-methylidene-1,3-oxazolidine (CID 155347226) is (4E)-2-methyl-4-(3-methylbut-2-enylidene)-5-methylidene-1,3-oxazolidine.
What is the SMILES notation for (4E)-2-methyl-4-(3-methylbut-2-enylidene)-5-methylidene-1,3-oxazolidine?
The canonical SMILES for (4E)-2-methyl-4-(3-methylbut-2-enylidene)-5-methylidene-1,3-oxazolidine is C=C1OC(C)N/C1=C/C=C(C)C.
What is the InChIKey of (4E)-2-methyl-4-(3-methylbut-2-enylidene)-5-methylidene-1,3-oxazolidine?
The InChIKey is OCLQUPMBZMLKIT-UXBLZVDNSA-N. The full InChI is InChI=1S/C10H15NO/c1-7(2)5-6-10-8(3)12-9(4)11-10/h5-6,9,11H,3H2,1-2,4H3/b10-6+.
What are the key properties of (4E)-2-methyl-4-(3-methylbut-2-enylidene)-5-methylidene-1,3-oxazolidine?
(4E)-2-methyl-4-(3-methylbut-2-enylidene)-5-methylidene-1,3-oxazolidine has a molecular weight of 165.24 g/mol, XLogP of 2.32, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4E)-2-methyl-4-(3-methylbut-2-enylidene)-5-methylidene-1,3-oxazolidine is sourced from PubChem (CID 155347226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).