3-(2-methoxyethoxy)-N-methylpropan-1-amine

C7H17NO2 — CID 58311479

IUPAC3-(2-methoxyethoxy)-N-methylpropan-1-amine
SMILESCNCCCOCCOC
InChIInChI=1S/C7H17NO2/c1-8-4-3-5-10-7-6-9-2/h8H,3-7H2,1-2H3
InChIKeyDGJYUIDSHSWHGC-UHFFFAOYSA-N
MW147.22 g/mol
LogP0.26
Rot. Bonds7

About 3-(2-methoxyethoxy)-N-methylpropan-1-amine

3-(2-methoxyethoxy)-N-methylpropan-1-amine (PubChem CID 58311479) has the molecular formula C7H17NO2 and a molecular weight of 147.22 g/mol. Its IUPAC name is 3-(2-methoxyethoxy)-N-methylpropan-1-amine.

Molecular Properties

Compound Name3-(2-methoxyethoxy)-N-methylpropan-1-amine
PubChem CID58311479
Molecular FormulaC7H17NO2
Molecular Weight147.22 g/mol
Exact Mass147.13
IUPAC Name3-(2-methoxyethoxy)-N-methylpropan-1-amine
SMILESCNCCCOCCOC
InChIInChI=1S/C7H17NO2/c1-8-4-3-5-10-7-6-9-2/h8H,3-7H2,1-2H3
InChIKeyDGJYUIDSHSWHGC-UHFFFAOYSA-N
XLogP0.26
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethoxy)-N-methylpropan-1-amine?
The IUPAC name of 3-(2-methoxyethoxy)-N-methylpropan-1-amine (CID 58311479) is 3-(2-methoxyethoxy)-N-methylpropan-1-amine.
What is the SMILES notation for 3-(2-methoxyethoxy)-N-methylpropan-1-amine?
The canonical SMILES for 3-(2-methoxyethoxy)-N-methylpropan-1-amine is CNCCCOCCOC.
What is the InChIKey of 3-(2-methoxyethoxy)-N-methylpropan-1-amine?
The InChIKey is DGJYUIDSHSWHGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO2/c1-8-4-3-5-10-7-6-9-2/h8H,3-7H2,1-2H3.
What are the key properties of 3-(2-methoxyethoxy)-N-methylpropan-1-amine?
3-(2-methoxyethoxy)-N-methylpropan-1-amine has a molecular weight of 147.22 g/mol, XLogP of 0.26, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethoxy)-N-methylpropan-1-amine is sourced from PubChem (CID 58311479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).