3-methoxy-2-(methoxymethyl)propan-1-amine

C6H15NO2 — CID 91047226

IUPAC3-methoxy-2-(methoxymethyl)propan-1-amine
SMILESCOCC(CN)COC
InChIInChI=1S/C6H15NO2/c1-8-4-6(3-7)5-9-2/h6H,3-5,7H2,1-2H3
InChIKeyNITUPEOBTWTHFD-UHFFFAOYSA-N
MW133.19 g/mol
LogP-0.15
Rot. Bonds5

About 3-methoxy-2-(methoxymethyl)propan-1-amine

3-methoxy-2-(methoxymethyl)propan-1-amine (PubChem CID 91047226) has the molecular formula C6H15NO2 and a molecular weight of 133.19 g/mol. Its IUPAC name is 3-methoxy-2-(methoxymethyl)propan-1-amine.

Molecular Properties

Compound Name3-methoxy-2-(methoxymethyl)propan-1-amine
PubChem CID91047226
Molecular FormulaC6H15NO2
Molecular Weight133.19 g/mol
Exact Mass133.11
IUPAC Name3-methoxy-2-(methoxymethyl)propan-1-amine
SMILESCOCC(CN)COC
InChIInChI=1S/C6H15NO2/c1-8-4-6(3-7)5-9-2/h6H,3-5,7H2,1-2H3
InChIKeyNITUPEOBTWTHFD-UHFFFAOYSA-N
XLogP-0.15
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.19
LogP ≤ 5-0.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-(methoxymethyl)propan-1-amine?
The IUPAC name of 3-methoxy-2-(methoxymethyl)propan-1-amine (CID 91047226) is 3-methoxy-2-(methoxymethyl)propan-1-amine.
What is the SMILES notation for 3-methoxy-2-(methoxymethyl)propan-1-amine?
The canonical SMILES for 3-methoxy-2-(methoxymethyl)propan-1-amine is COCC(CN)COC.
What is the InChIKey of 3-methoxy-2-(methoxymethyl)propan-1-amine?
The InChIKey is NITUPEOBTWTHFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO2/c1-8-4-6(3-7)5-9-2/h6H,3-5,7H2,1-2H3.
What are the key properties of 3-methoxy-2-(methoxymethyl)propan-1-amine?
3-methoxy-2-(methoxymethyl)propan-1-amine has a molecular weight of 133.19 g/mol, XLogP of -0.15, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-(methoxymethyl)propan-1-amine is sourced from PubChem (CID 91047226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).