N-(2-methoxyethoxymethoxy)propan-2-imine

C7H15NO3 — CID 14615187

IUPACN-(2-methoxyethoxymethoxy)propan-2-imine
SMILESCOCCOCON=C(C)C
InChIInChI=1S/C7H15NO3/c1-7(2)8-11-6-10-5-4-9-3/h4-6H2,1-3H3
InChIKeyXNNARAPDRXRFSS-UHFFFAOYSA-N
MW161.20 g/mol
LogP1.02
Rot. Bonds6

About N-(2-methoxyethoxymethoxy)propan-2-imine

N-(2-methoxyethoxymethoxy)propan-2-imine (PubChem CID 14615187) has the molecular formula C7H15NO3 and a molecular weight of 161.20 g/mol. Its IUPAC name is N-(2-methoxyethoxymethoxy)propan-2-imine.

Molecular Properties

Compound NameN-(2-methoxyethoxymethoxy)propan-2-imine
PubChem CID14615187
Molecular FormulaC7H15NO3
Molecular Weight161.20 g/mol
Exact Mass161.11
IUPAC NameN-(2-methoxyethoxymethoxy)propan-2-imine
SMILESCOCCOCON=C(C)C
InChIInChI=1S/C7H15NO3/c1-7(2)8-11-6-10-5-4-9-3/h4-6H2,1-3H3
InChIKeyXNNARAPDRXRFSS-UHFFFAOYSA-N
XLogP1.02
TPSA40.05 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 51.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethoxymethoxy)propan-2-imine?
The IUPAC name of N-(2-methoxyethoxymethoxy)propan-2-imine (CID 14615187) is N-(2-methoxyethoxymethoxy)propan-2-imine.
What is the SMILES notation for N-(2-methoxyethoxymethoxy)propan-2-imine?
The canonical SMILES for N-(2-methoxyethoxymethoxy)propan-2-imine is COCCOCON=C(C)C.
What is the InChIKey of N-(2-methoxyethoxymethoxy)propan-2-imine?
The InChIKey is XNNARAPDRXRFSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO3/c1-7(2)8-11-6-10-5-4-9-3/h4-6H2,1-3H3.
What are the key properties of N-(2-methoxyethoxymethoxy)propan-2-imine?
N-(2-methoxyethoxymethoxy)propan-2-imine has a molecular weight of 161.20 g/mol, XLogP of 1.02, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethoxymethoxy)propan-2-imine is sourced from PubChem (CID 14615187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).