1,5-dimethoxy-3-methyloctan-4-amine

C11H25NO2 — CID 116718705

IUPAC1,5-dimethoxy-3-methyloctan-4-amine
SMILESCCCC(OC)C(N)C(C)CCOC
InChIInChI=1S/C11H25NO2/c1-5-6-10(14-4)11(12)9(2)7-8-13-3/h9-11H,5-8,12H2,1-4H3
InChIKeyICODVJJMHDFVJD-UHFFFAOYSA-N
MW203.33 g/mol
LogP1.80
Rot. Bonds8

About 1,5-dimethoxy-3-methyloctan-4-amine

1,5-dimethoxy-3-methyloctan-4-amine (PubChem CID 116718705) has the molecular formula C11H25NO2 and a molecular weight of 203.33 g/mol. Its IUPAC name is 1,5-dimethoxy-3-methyloctan-4-amine.

Molecular Properties

Compound Name1,5-dimethoxy-3-methyloctan-4-amine
PubChem CID116718705
Molecular FormulaC11H25NO2
Molecular Weight203.33 g/mol
Exact Mass203.19
IUPAC Name1,5-dimethoxy-3-methyloctan-4-amine
SMILESCCCC(OC)C(N)C(C)CCOC
InChIInChI=1S/C11H25NO2/c1-5-6-10(14-4)11(12)9(2)7-8-13-3/h9-11H,5-8,12H2,1-4H3
InChIKeyICODVJJMHDFVJD-UHFFFAOYSA-N
XLogP1.80
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,5-dimethoxy-3-methylheptan-4-amine
CID 116715297
1,5-dimethoxy-N,3-dimethyloctan-4-amine
CID 116718993
3-methoxy-2-methylhexane
CID 23384964
1-methoxy-3-methylhexan-2-amine
CID 105008836
1-methoxyheptan-4-amine
CID 43370439
1-methoxy-3,6-dimethyloctan-4-amine
CID 105044592
3-methoxy-1-propoxyhexan-2-amine
CID 116718707
1,3-dimethoxyhexan-2-ol
CID 116711716
1,1,1-trifluoro-5-methoxy-3-methylpentan-2-amine
CID 105044294
7-ethoxy-1-methoxy-3-methylheptan-4-amine
CID 105185117
tris(3-methoxyheptan-4-yl) phosphate
CID 154210175
4-methoxy-2-methylheptan-3-ol
CID 116711593

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethoxy-3-methyloctan-4-amine?
The IUPAC name of 1,5-dimethoxy-3-methyloctan-4-amine (CID 116718705) is 1,5-dimethoxy-3-methyloctan-4-amine.
What is the SMILES notation for 1,5-dimethoxy-3-methyloctan-4-amine?
The canonical SMILES for 1,5-dimethoxy-3-methyloctan-4-amine is CCCC(OC)C(N)C(C)CCOC.
What is the InChIKey of 1,5-dimethoxy-3-methyloctan-4-amine?
The InChIKey is ICODVJJMHDFVJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO2/c1-5-6-10(14-4)11(12)9(2)7-8-13-3/h9-11H,5-8,12H2,1-4H3.
What are the key properties of 1,5-dimethoxy-3-methyloctan-4-amine?
1,5-dimethoxy-3-methyloctan-4-amine has a molecular weight of 203.33 g/mol, XLogP of 1.80, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethoxy-3-methyloctan-4-amine is sourced from PubChem (CID 116718705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).