4-methyl-2-(6-methylhept-5-en-2-yl)-3-propan-2-yl-1,3-oxazolidine

C15H29NO — CID 59085426

IUPAC4-methyl-2-(6-methylhept-5-en-2-yl)-3-propan-2-yl-1,3-oxazolidine
SMILESCC(C)=CCCC(C)C1OCC(C)N1C(C)C
InChIInChI=1S/C15H29NO/c1-11(2)8-7-9-13(5)15-16(12(3)4)14(6)10-17-15/h8,12-15H,7,9-10H2,1-6H3
InChIKeySLFLFWJSXLFNRY-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.82
Rot. Bonds5

About 4-methyl-2-(6-methylhept-5-en-2-yl)-3-propan-2-yl-1,3-oxazolidine

4-methyl-2-(6-methylhept-5-en-2-yl)-3-propan-2-yl-1,3-oxazolidine (PubChem CID 59085426) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is 4-methyl-2-(6-methylhept-5-en-2-yl)-3-propan-2-yl-1,3-oxazolidine.

Molecular Properties

Compound Name4-methyl-2-(6-methylhept-5-en-2-yl)-3-propan-2-yl-1,3-oxazolidine
PubChem CID59085426
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name4-methyl-2-(6-methylhept-5-en-2-yl)-3-propan-2-yl-1,3-oxazolidine
SMILESCC(C)=CCCC(C)C1OCC(C)N1C(C)C
InChIInChI=1S/C15H29NO/c1-11(2)8-7-9-13(5)15-16(12(3)4)14(6)10-17-15/h8,12-15H,7,9-10H2,1-6H3
InChIKeySLFLFWJSXLFNRY-UHFFFAOYSA-N
XLogP3.82
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(6-methylhept-5-en-2-yl)-3-propan-2-yl-1,3-oxazolidine?
The IUPAC name of 4-methyl-2-(6-methylhept-5-en-2-yl)-3-propan-2-yl-1,3-oxazolidine (CID 59085426) is 4-methyl-2-(6-methylhept-5-en-2-yl)-3-propan-2-yl-1,3-oxazolidine.
What is the SMILES notation for 4-methyl-2-(6-methylhept-5-en-2-yl)-3-propan-2-yl-1,3-oxazolidine?
The canonical SMILES for 4-methyl-2-(6-methylhept-5-en-2-yl)-3-propan-2-yl-1,3-oxazolidine is CC(C)=CCCC(C)C1OCC(C)N1C(C)C.
What is the InChIKey of 4-methyl-2-(6-methylhept-5-en-2-yl)-3-propan-2-yl-1,3-oxazolidine?
The InChIKey is SLFLFWJSXLFNRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-11(2)8-7-9-13(5)15-16(12(3)4)14(6)10-17-15/h8,12-15H,7,9-10H2,1-6H3.
What are the key properties of 4-methyl-2-(6-methylhept-5-en-2-yl)-3-propan-2-yl-1,3-oxazolidine?
4-methyl-2-(6-methylhept-5-en-2-yl)-3-propan-2-yl-1,3-oxazolidine has a molecular weight of 239.40 g/mol, XLogP of 3.82, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(6-methylhept-5-en-2-yl)-3-propan-2-yl-1,3-oxazolidine is sourced from PubChem (CID 59085426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).