1-[ethoxy(methyl)amino]propan-2-ol

C6H15NO2 — CID 87381608

IUPAC1-[ethoxy(methyl)amino]propan-2-ol
SMILESCCON(C)CC(C)O
InChIInChI=1S/C6H15NO2/c1-4-9-7(3)5-6(2)8/h6,8H,4-5H2,1-3H3
InChIKeyALFDKYBUBLNDJI-UHFFFAOYSA-N
MW133.19 g/mol
LogP0.25
Rot. Bonds4

About 1-[ethoxy(methyl)amino]propan-2-ol

1-[ethoxy(methyl)amino]propan-2-ol (PubChem CID 87381608) has the molecular formula C6H15NO2 and a molecular weight of 133.19 g/mol. Its IUPAC name is 1-[ethoxy(methyl)amino]propan-2-ol.

Molecular Properties

Compound Name1-[ethoxy(methyl)amino]propan-2-ol
PubChem CID87381608
Molecular FormulaC6H15NO2
Molecular Weight133.19 g/mol
Exact Mass133.11
IUPAC Name1-[ethoxy(methyl)amino]propan-2-ol
SMILESCCON(C)CC(C)O
InChIInChI=1S/C6H15NO2/c1-4-9-7(3)5-6(2)8/h6,8H,4-5H2,1-3H3
InChIKeyALFDKYBUBLNDJI-UHFFFAOYSA-N
XLogP0.25
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.19
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-[[2-hydroxypropyl(methyl)amino]methyl-methylamino]propan-2-ol
CID 20820329
(2S)-1-[[bis[(2R)-2-hydroxypropyl]amino]-[(2S)-2-hydroxypropyl]amino]propan-2-ol
CID 92557045
N-(2-hydroxypropyl)-N-methylpropanamide
CID 18720717
1-[bis(trideuteriomethyl)amino]propan-2-ol
CID 121487893
(2S)-1-[1-methoxypropan-2-yl(methyl)amino]propan-2-ol
CID 103935012
ethyl 2-[2-hydroxypropyl(methyl)amino]-2-oxoacetate
CID 62338582
(2S)-1-[amino(methyl)amino]propan-2-ol
CID 124512357
(2S)-1-[methyl(propan-2-yl)amino]propan-2-ol
CID 93346500
N-butoxy-N,2-dimethylpropan-1-amine
CID 166738532
1-[ethyl(hydroxymethyl)amino]propan-2-ol
CID 22642430
(2R)-1-[butan-2-yl(ethyl)amino]propan-2-ol
CID 103934940
(2S)-1-[methyl(pentan-2-yl)amino]propan-2-ol
CID 103934964

Frequently Asked Questions

What is the IUPAC name of 1-[ethoxy(methyl)amino]propan-2-ol?
The IUPAC name of 1-[ethoxy(methyl)amino]propan-2-ol (CID 87381608) is 1-[ethoxy(methyl)amino]propan-2-ol.
What is the SMILES notation for 1-[ethoxy(methyl)amino]propan-2-ol?
The canonical SMILES for 1-[ethoxy(methyl)amino]propan-2-ol is CCON(C)CC(C)O.
What is the InChIKey of 1-[ethoxy(methyl)amino]propan-2-ol?
The InChIKey is ALFDKYBUBLNDJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO2/c1-4-9-7(3)5-6(2)8/h6,8H,4-5H2,1-3H3.
What are the key properties of 1-[ethoxy(methyl)amino]propan-2-ol?
1-[ethoxy(methyl)amino]propan-2-ol has a molecular weight of 133.19 g/mol, XLogP of 0.25, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[ethoxy(methyl)amino]propan-2-ol is sourced from PubChem (CID 87381608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).