1-(methoxymethoxy)-N,N-bis(methoxymethoxymethyl)methanamine

C9H21NO6 — CID 23435146

IUPAC1-(methoxymethoxy)-N,N-bis(methoxymethoxymethyl)methanamine
SMILESCOCOCN(COCOC)COCOC
InChIInChI=1S/C9H21NO6/c1-11-7-14-4-10(5-15-8-12-2)6-16-9-13-3/h4-9H2,1-3H3
InChIKeyWKQSQIMRHAAFRB-UHFFFAOYSA-N
MW239.27 g/mol
LogP0.02
Rot. Bonds12

About 1-(methoxymethoxy)-N,N-bis(methoxymethoxymethyl)methanamine

1-(methoxymethoxy)-N,N-bis(methoxymethoxymethyl)methanamine (PubChem CID 23435146) has the molecular formula C9H21NO6 and a molecular weight of 239.27 g/mol. Its IUPAC name is 1-(methoxymethoxy)-N,N-bis(methoxymethoxymethyl)methanamine.

Molecular Properties

Compound Name1-(methoxymethoxy)-N,N-bis(methoxymethoxymethyl)methanamine
PubChem CID23435146
Molecular FormulaC9H21NO6
Molecular Weight239.27 g/mol
Exact Mass239.14
IUPAC Name1-(methoxymethoxy)-N,N-bis(methoxymethoxymethyl)methanamine
SMILESCOCOCN(COCOC)COCOC
InChIInChI=1S/C9H21NO6/c1-11-7-14-4-10(5-15-8-12-2)6-16-9-13-3/h4-9H2,1-3H3
InChIKeyWKQSQIMRHAAFRB-UHFFFAOYSA-N
XLogP0.02
TPSA58.62 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds12
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 50.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-(methoxymethoxy)-N,N-bis(methoxymethoxymethyl)methanamine?
The IUPAC name of 1-(methoxymethoxy)-N,N-bis(methoxymethoxymethyl)methanamine (CID 23435146) is 1-(methoxymethoxy)-N,N-bis(methoxymethoxymethyl)methanamine.
What is the SMILES notation for 1-(methoxymethoxy)-N,N-bis(methoxymethoxymethyl)methanamine?
The canonical SMILES for 1-(methoxymethoxy)-N,N-bis(methoxymethoxymethyl)methanamine is COCOCN(COCOC)COCOC.
What is the InChIKey of 1-(methoxymethoxy)-N,N-bis(methoxymethoxymethyl)methanamine?
The InChIKey is WKQSQIMRHAAFRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO6/c1-11-7-14-4-10(5-15-8-12-2)6-16-9-13-3/h4-9H2,1-3H3.
What are the key properties of 1-(methoxymethoxy)-N,N-bis(methoxymethoxymethyl)methanamine?
1-(methoxymethoxy)-N,N-bis(methoxymethoxymethyl)methanamine has a molecular weight of 239.27 g/mol, XLogP of 0.02, 12 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethoxy)-N,N-bis(methoxymethoxymethyl)methanamine is sourced from PubChem (CID 23435146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).