2-methoxy-6-(oxolan-2-yl)hexan-3-amine

C11H23NO2 — CID 79617762

IUPAC2-methoxy-6-(oxolan-2-yl)hexan-3-amine
SMILESCOC(C)C(N)CCCC1CCCO1
InChIInChI=1S/C11H23NO2/c1-9(13-2)11(12)7-3-5-10-6-4-8-14-10/h9-11H,3-8,12H2,1-2H3
InChIKeyMAOGHRYQRBLMDD-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.70
Rot. Bonds6

About 2-methoxy-6-(oxolan-2-yl)hexan-3-amine

2-methoxy-6-(oxolan-2-yl)hexan-3-amine (PubChem CID 79617762) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 2-methoxy-6-(oxolan-2-yl)hexan-3-amine.

Molecular Properties

Compound Name2-methoxy-6-(oxolan-2-yl)hexan-3-amine
PubChem CID79617762
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name2-methoxy-6-(oxolan-2-yl)hexan-3-amine
SMILESCOC(C)C(N)CCCC1CCCO1
InChIInChI=1S/C11H23NO2/c1-9(13-2)11(12)7-3-5-10-6-4-8-14-10/h9-11H,3-8,12H2,1-2H3
InChIKeyMAOGHRYQRBLMDD-UHFFFAOYSA-N
XLogP1.70
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,1-difluoro-5-(oxolan-2-yl)pentan-2-amine
CID 103516724
1-methoxy-7-(oxolan-2-yl)heptan-4-amine
CID 65164869
4-methyl-7-(oxolan-2-yl)heptan-2-amine
CID 65164978
5-methoxy-5-methyl-1-(oxolan-2-yl)heptan-4-amine
CID 116757408
2-(5-chloro-4-methylpentyl)oxolane
CID 65165310
(2R)-4-[(2R)-oxolan-2-yl]butan-2-amine
CID 7380763
3-methyl-6-(oxolan-2-yl)hexan-1-amine
CID 81013220
2-[4-[5-(oxolan-2-yl)pentan-2-ylsulfanyl]pentyl]oxolane
CID 54448834
3-methyl-6-(oxolan-2-yl)hexan-2-ol
CID 65166050
1-cyclohexyl-1-methoxy-4-(oxolan-2-yl)butan-2-amine
CID 116771262
[5-methyl-1-(oxolan-2-yl)heptan-4-yl]hydrazine
CID 105219692
1,1-difluoro-4-(oxolan-2-yl)butan-2-amine
CID 103516728

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-(oxolan-2-yl)hexan-3-amine?
The IUPAC name of 2-methoxy-6-(oxolan-2-yl)hexan-3-amine (CID 79617762) is 2-methoxy-6-(oxolan-2-yl)hexan-3-amine.
What is the SMILES notation for 2-methoxy-6-(oxolan-2-yl)hexan-3-amine?
The canonical SMILES for 2-methoxy-6-(oxolan-2-yl)hexan-3-amine is COC(C)C(N)CCCC1CCCO1.
What is the InChIKey of 2-methoxy-6-(oxolan-2-yl)hexan-3-amine?
The InChIKey is MAOGHRYQRBLMDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-9(13-2)11(12)7-3-5-10-6-4-8-14-10/h9-11H,3-8,12H2,1-2H3.
What are the key properties of 2-methoxy-6-(oxolan-2-yl)hexan-3-amine?
2-methoxy-6-(oxolan-2-yl)hexan-3-amine has a molecular weight of 201.31 g/mol, XLogP of 1.70, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-(oxolan-2-yl)hexan-3-amine is sourced from PubChem (CID 79617762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).