ethane;2-methoxy-N,N,6-trimethyloxan-4-amine

C11H25NO2 — CID 143454744

IUPACethane;2-methoxy-N,N,6-trimethyloxan-4-amine
SMILESCC.COC1CC(N(C)C)CC(C)O1
InChIInChI=1S/C9H19NO2.C2H6/c1-7-5-8(10(2)3)6-9(11-4)12-7;1-2/h7-9H,5-6H2,1-4H3;1-2H3
InChIKeyJEPZJDJSSDLYIP-UHFFFAOYSA-N
MW203.33 g/mol
LogP2.11
Rot. Bonds2

About ethane;2-methoxy-N,N,6-trimethyloxan-4-amine

ethane;2-methoxy-N,N,6-trimethyloxan-4-amine (PubChem CID 143454744) has the molecular formula C11H25NO2 and a molecular weight of 203.33 g/mol. Its IUPAC name is ethane;2-methoxy-N,N,6-trimethyloxan-4-amine.

Molecular Properties

Compound Nameethane;2-methoxy-N,N,6-trimethyloxan-4-amine
PubChem CID143454744
Molecular FormulaC11H25NO2
Molecular Weight203.33 g/mol
Exact Mass203.19
IUPAC Nameethane;2-methoxy-N,N,6-trimethyloxan-4-amine
SMILESCC.COC1CC(N(C)C)CC(C)O1
InChIInChI=1S/C9H19NO2.C2H6/c1-7-5-8(10(2)3)6-9(11-4)12-7;1-2/h7-9H,5-6H2,1-4H3;1-2H3
InChIKeyJEPZJDJSSDLYIP-UHFFFAOYSA-N
XLogP2.11
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;2-methoxy-N,N,6-trimethyloxan-4-amine?
The IUPAC name of ethane;2-methoxy-N,N,6-trimethyloxan-4-amine (CID 143454744) is ethane;2-methoxy-N,N,6-trimethyloxan-4-amine.
What is the SMILES notation for ethane;2-methoxy-N,N,6-trimethyloxan-4-amine?
The canonical SMILES for ethane;2-methoxy-N,N,6-trimethyloxan-4-amine is CC.COC1CC(N(C)C)CC(C)O1.
What is the InChIKey of ethane;2-methoxy-N,N,6-trimethyloxan-4-amine?
The InChIKey is JEPZJDJSSDLYIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2.C2H6/c1-7-5-8(10(2)3)6-9(11-4)12-7;1-2/h7-9H,5-6H2,1-4H3;1-2H3.
What are the key properties of ethane;2-methoxy-N,N,6-trimethyloxan-4-amine?
ethane;2-methoxy-N,N,6-trimethyloxan-4-amine has a molecular weight of 203.33 g/mol, XLogP of 2.11, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methoxy-N,N,6-trimethyloxan-4-amine is sourced from PubChem (CID 143454744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).