1-methoxy-N-(1-methoxypropyl)propan-1-amine

C8H19NO2 — CID 22722386

IUPAC1-methoxy-N-(1-methoxypropyl)propan-1-amine
SMILESCCC(NC(CC)OC)OC
InChIInChI=1S/C8H19NO2/c1-5-7(10-3)9-8(6-2)11-4/h7-9H,5-6H2,1-4H3
InChIKeyLKRDCYCUBIRXEO-UHFFFAOYSA-N
MW161.25 g/mol
LogP1.34
Rot. Bonds6

About 1-methoxy-N-(1-methoxypropyl)propan-1-amine

1-methoxy-N-(1-methoxypropyl)propan-1-amine (PubChem CID 22722386) has the molecular formula C8H19NO2 and a molecular weight of 161.25 g/mol. Its IUPAC name is 1-methoxy-N-(1-methoxypropyl)propan-1-amine.

Molecular Properties

Compound Name1-methoxy-N-(1-methoxypropyl)propan-1-amine
PubChem CID22722386
Molecular FormulaC8H19NO2
Molecular Weight161.25 g/mol
Exact Mass161.14
IUPAC Name1-methoxy-N-(1-methoxypropyl)propan-1-amine
SMILESCCC(NC(CC)OC)OC
InChIInChI=1S/C8H19NO2/c1-5-7(10-3)9-8(6-2)11-4/h7-9H,5-6H2,1-4H3
InChIKeyLKRDCYCUBIRXEO-UHFFFAOYSA-N
XLogP1.34
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-N-(1-methoxypropyl)propan-1-amine?
The IUPAC name of 1-methoxy-N-(1-methoxypropyl)propan-1-amine (CID 22722386) is 1-methoxy-N-(1-methoxypropyl)propan-1-amine.
What is the SMILES notation for 1-methoxy-N-(1-methoxypropyl)propan-1-amine?
The canonical SMILES for 1-methoxy-N-(1-methoxypropyl)propan-1-amine is CCC(NC(CC)OC)OC.
What is the InChIKey of 1-methoxy-N-(1-methoxypropyl)propan-1-amine?
The InChIKey is LKRDCYCUBIRXEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO2/c1-5-7(10-3)9-8(6-2)11-4/h7-9H,5-6H2,1-4H3.
What are the key properties of 1-methoxy-N-(1-methoxypropyl)propan-1-amine?
1-methoxy-N-(1-methoxypropyl)propan-1-amine has a molecular weight of 161.25 g/mol, XLogP of 1.34, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-N-(1-methoxypropyl)propan-1-amine is sourced from PubChem (CID 22722386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).