3-methoxy-3-methylbutan-1-amine

C6H15NO — CID 22273167

IUPAC3-methoxy-3-methylbutan-1-amine
SMILESCOC(C)(C)CCN
InChIInChI=1S/C6H15NO/c1-6(2,8-3)4-5-7/h4-5,7H2,1-3H3
InChIKeyCLOYVCHXXWLKSL-UHFFFAOYSA-N
MW117.19 g/mol
LogP0.76
Rot. Bonds3

About 3-methoxy-3-methylbutan-1-amine

3-methoxy-3-methylbutan-1-amine (PubChem CID 22273167) has the molecular formula C6H15NO and a molecular weight of 117.19 g/mol. Its IUPAC name is 3-methoxy-3-methylbutan-1-amine.

Molecular Properties

Compound Name3-methoxy-3-methylbutan-1-amine
PubChem CID22273167
Molecular FormulaC6H15NO
Molecular Weight117.19 g/mol
Exact Mass117.12
IUPAC Name3-methoxy-3-methylbutan-1-amine
SMILESCOC(C)(C)CCN
InChIInChI=1S/C6H15NO/c1-6(2,8-3)4-5-7/h4-5,7H2,1-3H3
InChIKeyCLOYVCHXXWLKSL-UHFFFAOYSA-N
XLogP0.76
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.19
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

CID 62353625
CID 62353625
CID 83872178
CID 83872178
CID 89813937
CID 89813937
CID 158593338
CID 158593338
CID 105434675
CID 105434675
CID 105482747
CID 105482747
CID 82229615
CID 82229615
CID 83904847
CID 83904847
CID 87748688
CID 87748688
CID 88857781
CID 88857781
CID 89827727
CID 89827727
CID 91003032
CID 91003032

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-3-methylbutan-1-amine?
The IUPAC name of 3-methoxy-3-methylbutan-1-amine (CID 22273167) is 3-methoxy-3-methylbutan-1-amine.
What is the SMILES notation for 3-methoxy-3-methylbutan-1-amine?
The canonical SMILES for 3-methoxy-3-methylbutan-1-amine is COC(C)(C)CCN.
What is the InChIKey of 3-methoxy-3-methylbutan-1-amine?
The InChIKey is CLOYVCHXXWLKSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO/c1-6(2,8-3)4-5-7/h4-5,7H2,1-3H3.
What are the key properties of 3-methoxy-3-methylbutan-1-amine?
3-methoxy-3-methylbutan-1-amine has a molecular weight of 117.19 g/mol, XLogP of 0.76, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-3-methylbutan-1-amine is sourced from PubChem (CID 22273167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).