3-ethoxy-2-methylpropan-1-amine

C6H15NO — CID 43175050

IUPAC3-ethoxy-2-methylpropan-1-amine
SMILESCCOCC(C)CN
InChIInChI=1S/C6H15NO/c1-3-8-5-6(2)4-7/h6H,3-5,7H2,1-2H3
InChIKeyFGUCWPSRTBOLSK-UHFFFAOYSA-N
MW117.19 g/mol
LogP0.62
Rot. Bonds4

About 3-ethoxy-2-methylpropan-1-amine

3-ethoxy-2-methylpropan-1-amine (PubChem CID 43175050) has the molecular formula C6H15NO and a molecular weight of 117.19 g/mol. Its IUPAC name is 3-ethoxy-2-methylpropan-1-amine.

Molecular Properties

Compound Name3-ethoxy-2-methylpropan-1-amine
PubChem CID43175050
Molecular FormulaC6H15NO
Molecular Weight117.19 g/mol
Exact Mass117.12
IUPAC Name3-ethoxy-2-methylpropan-1-amine
SMILESCCOCC(C)CN
InChIInChI=1S/C6H15NO/c1-3-8-5-6(2)4-7/h6H,3-5,7H2,1-2H3
InChIKeyFGUCWPSRTBOLSK-UHFFFAOYSA-N
XLogP0.62
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.19
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-N-(1-ethoxypropan-2-yl)propane-1,2-diamine
CID 103389655
1-(3-amino-2-methylpropyl)sulfanyl-3-ethoxypropan-2-ol
CID 66225458
1,4-diethoxy-2-methylbutane
CID 59899860
2-methyl-3-pent-4-enoxypropan-1-amine
CID 103074871
4-amino-N-(1-ethoxypropan-2-yl)-3-methylbutanamide
CID 81087723
1-ethoxypropan-2-yl 5-amino-4-methylpentanoate
CID 103488924
1-amino-3-(3-ethoxy-2-hydroxypropoxy)propan-2-ol
CID 58703853
3-(2-cyclopropylethoxy)-2-methylpropan-1-amine
CID 106203362
3-(ethoxymethylsulfinyl)-2-methylpropan-1-amine
CID 81201842
(3S)-4-ethoxy-3-methylbutanoic acid
CID 59960254
1-ethoxy-2-methylpropane;1-propoxypropane
CID 174535854
2-methyl-3-(methylaminooxy)propan-1-amine
CID 20681277

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-2-methylpropan-1-amine?
The IUPAC name of 3-ethoxy-2-methylpropan-1-amine (CID 43175050) is 3-ethoxy-2-methylpropan-1-amine.
What is the SMILES notation for 3-ethoxy-2-methylpropan-1-amine?
The canonical SMILES for 3-ethoxy-2-methylpropan-1-amine is CCOCC(C)CN.
What is the InChIKey of 3-ethoxy-2-methylpropan-1-amine?
The InChIKey is FGUCWPSRTBOLSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO/c1-3-8-5-6(2)4-7/h6H,3-5,7H2,1-2H3.
What are the key properties of 3-ethoxy-2-methylpropan-1-amine?
3-ethoxy-2-methylpropan-1-amine has a molecular weight of 117.19 g/mol, XLogP of 0.62, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-2-methylpropan-1-amine is sourced from PubChem (CID 43175050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).