2-methyl-2-[2-(2-methyl-6-methylidenecyclohexen-1-yl)ethyl]-1,3-oxazinane

C15H25NO — CID 88974819

IUPAC2-methyl-2-[2-(2-methyl-6-methylidenecyclohexen-1-yl)ethyl]-1,3-oxazinane
SMILESC=C1CCCC(C)=C1CCC1(C)NCCCO1
InChIInChI=1S/C15H25NO/c1-12-6-4-7-13(2)14(12)8-9-15(3)16-10-5-11-17-15/h16H,1,4-11H2,2-3H3
InChIKeyVYFNOQGAKKPALI-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.55
Rot. Bonds3

About 2-methyl-2-[2-(2-methyl-6-methylidenecyclohexen-1-yl)ethyl]-1,3-oxazinane

2-methyl-2-[2-(2-methyl-6-methylidenecyclohexen-1-yl)ethyl]-1,3-oxazinane (PubChem CID 88974819) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is 2-methyl-2-[2-(2-methyl-6-methylidenecyclohexen-1-yl)ethyl]-1,3-oxazinane.

Molecular Properties

Compound Name2-methyl-2-[2-(2-methyl-6-methylidenecyclohexen-1-yl)ethyl]-1,3-oxazinane
PubChem CID88974819
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC Name2-methyl-2-[2-(2-methyl-6-methylidenecyclohexen-1-yl)ethyl]-1,3-oxazinane
SMILESC=C1CCCC(C)=C1CCC1(C)NCCCO1
InChIInChI=1S/C15H25NO/c1-12-6-4-7-13(2)14(12)8-9-15(3)16-10-5-11-17-15/h16H,1,4-11H2,2-3H3
InChIKeyVYFNOQGAKKPALI-UHFFFAOYSA-N
XLogP3.55
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[2-(2-methyl-6-methylidenecyclohexen-1-yl)ethyl]-1,3-oxazinane?
The IUPAC name of 2-methyl-2-[2-(2-methyl-6-methylidenecyclohexen-1-yl)ethyl]-1,3-oxazinane (CID 88974819) is 2-methyl-2-[2-(2-methyl-6-methylidenecyclohexen-1-yl)ethyl]-1,3-oxazinane.
What is the SMILES notation for 2-methyl-2-[2-(2-methyl-6-methylidenecyclohexen-1-yl)ethyl]-1,3-oxazinane?
The canonical SMILES for 2-methyl-2-[2-(2-methyl-6-methylidenecyclohexen-1-yl)ethyl]-1,3-oxazinane is C=C1CCCC(C)=C1CCC1(C)NCCCO1.
What is the InChIKey of 2-methyl-2-[2-(2-methyl-6-methylidenecyclohexen-1-yl)ethyl]-1,3-oxazinane?
The InChIKey is VYFNOQGAKKPALI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO/c1-12-6-4-7-13(2)14(12)8-9-15(3)16-10-5-11-17-15/h16H,1,4-11H2,2-3H3.
What are the key properties of 2-methyl-2-[2-(2-methyl-6-methylidenecyclohexen-1-yl)ethyl]-1,3-oxazinane?
2-methyl-2-[2-(2-methyl-6-methylidenecyclohexen-1-yl)ethyl]-1,3-oxazinane has a molecular weight of 235.37 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[2-(2-methyl-6-methylidenecyclohexen-1-yl)ethyl]-1,3-oxazinane is sourced from PubChem (CID 88974819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).