1,5-dimethoxy-3-methylpentan-3-amine

C8H19NO2 — CID 114997128

IUPAC1,5-dimethoxy-3-methylpentan-3-amine
SMILESCOCCC(C)(N)CCOC
InChIInChI=1S/C8H19NO2/c1-8(9,4-6-10-2)5-7-11-3/h4-7,9H2,1-3H3
InChIKeyAZAVSMHZICSAJJ-UHFFFAOYSA-N
MW161.24 g/mol
LogP0.78
Rot. Bonds6

About 1,5-dimethoxy-3-methylpentan-3-amine

1,5-dimethoxy-3-methylpentan-3-amine (PubChem CID 114997128) has the molecular formula C8H19NO2 and a molecular weight of 161.24 g/mol. Its IUPAC name is 1,5-dimethoxy-3-methylpentan-3-amine.

Molecular Properties

Compound Name1,5-dimethoxy-3-methylpentan-3-amine
PubChem CID114997128
Molecular FormulaC8H19NO2
Molecular Weight161.24 g/mol
Exact Mass161.14
IUPAC Name1,5-dimethoxy-3-methylpentan-3-amine
SMILESCOCCC(C)(N)CCOC
InChIInChI=1S/C8H19NO2/c1-8(9,4-6-10-2)5-7-11-3/h4-7,9H2,1-3H3
InChIKeyAZAVSMHZICSAJJ-UHFFFAOYSA-N
XLogP0.78
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.24
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methoxy-3-methyldodecan-3-amine
CID 62620545
2-amino-4-(2-methoxyethoxy)-2-methylbutan-1-ol
CID 64804049
ethane;1-methoxy-3,3-dimethylbutane
CID 143141249
1,5-diethoxy-3-methylpentan-3-amine
CID 91552736
7-methoxy-3-methylheptan-3-amine
CID 104650485
2-amino-4-methoxy-2-methylbutanoic acid
CID 18323200
6-methoxy-2-methylhexan-2-amine
CID 94975413
1-(4-tert-butyl-1,3-thiazol-2-yl)-4-methoxy-2-methylbutan-2-amine
CID 79820562
4-methoxy-2-(4-methylcyclohexyl)butan-2-amine
CID 64748370
4-(1-methoxy-3-methylpentan-3-yl)oxy-2-methylbutan-2-amine
CID 142600828
1-methoxy-3-(2-methoxyethyl)-3-methylhexane
CID 57212260
1,5-dimethoxy-3-(2-methoxyethyl)pentan-3-ol
CID 54443930

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethoxy-3-methylpentan-3-amine?
The IUPAC name of 1,5-dimethoxy-3-methylpentan-3-amine (CID 114997128) is 1,5-dimethoxy-3-methylpentan-3-amine.
What is the SMILES notation for 1,5-dimethoxy-3-methylpentan-3-amine?
The canonical SMILES for 1,5-dimethoxy-3-methylpentan-3-amine is COCCC(C)(N)CCOC.
What is the InChIKey of 1,5-dimethoxy-3-methylpentan-3-amine?
The InChIKey is AZAVSMHZICSAJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO2/c1-8(9,4-6-10-2)5-7-11-3/h4-7,9H2,1-3H3.
What are the key properties of 1,5-dimethoxy-3-methylpentan-3-amine?
1,5-dimethoxy-3-methylpentan-3-amine has a molecular weight of 161.24 g/mol, XLogP of 0.78, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethoxy-3-methylpentan-3-amine is sourced from PubChem (CID 114997128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).