1-(2-methoxyethoxy)-N-(2-methoxyethoxymethyl)-N-methylmethanamine

C9H21NO4 — CID 87640725

IUPAC1-(2-methoxyethoxy)-N-(2-methoxyethoxymethyl)-N-methylmethanamine
SMILESCOCCOCN(C)COCCOC
InChIInChI=1S/C9H21NO4/c1-10(8-13-6-4-11-2)9-14-7-5-12-3/h4-9H2,1-3H3
InChIKeyIQFNMJVDNPIRFU-UHFFFAOYSA-N
MW207.27 g/mol
LogP0.16
Rot. Bonds10

About 1-(2-methoxyethoxy)-N-(2-methoxyethoxymethyl)-N-methylmethanamine

1-(2-methoxyethoxy)-N-(2-methoxyethoxymethyl)-N-methylmethanamine (PubChem CID 87640725) has the molecular formula C9H21NO4 and a molecular weight of 207.27 g/mol. Its IUPAC name is 1-(2-methoxyethoxy)-N-(2-methoxyethoxymethyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2-methoxyethoxy)-N-(2-methoxyethoxymethyl)-N-methylmethanamine
PubChem CID87640725
Molecular FormulaC9H21NO4
Molecular Weight207.27 g/mol
Exact Mass207.15
IUPAC Name1-(2-methoxyethoxy)-N-(2-methoxyethoxymethyl)-N-methylmethanamine
SMILESCOCCOCN(C)COCCOC
InChIInChI=1S/C9H21NO4/c1-10(8-13-6-4-11-2)9-14-7-5-12-3/h4-9H2,1-3H3
InChIKeyIQFNMJVDNPIRFU-UHFFFAOYSA-N
XLogP0.16
TPSA40.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 50.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethoxy)-N-(2-methoxyethoxymethyl)-N-methylmethanamine?
The IUPAC name of 1-(2-methoxyethoxy)-N-(2-methoxyethoxymethyl)-N-methylmethanamine (CID 87640725) is 1-(2-methoxyethoxy)-N-(2-methoxyethoxymethyl)-N-methylmethanamine.
What is the SMILES notation for 1-(2-methoxyethoxy)-N-(2-methoxyethoxymethyl)-N-methylmethanamine?
The canonical SMILES for 1-(2-methoxyethoxy)-N-(2-methoxyethoxymethyl)-N-methylmethanamine is COCCOCN(C)COCCOC.
What is the InChIKey of 1-(2-methoxyethoxy)-N-(2-methoxyethoxymethyl)-N-methylmethanamine?
The InChIKey is IQFNMJVDNPIRFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO4/c1-10(8-13-6-4-11-2)9-14-7-5-12-3/h4-9H2,1-3H3.
What are the key properties of 1-(2-methoxyethoxy)-N-(2-methoxyethoxymethyl)-N-methylmethanamine?
1-(2-methoxyethoxy)-N-(2-methoxyethoxymethyl)-N-methylmethanamine has a molecular weight of 207.27 g/mol, XLogP of 0.16, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethoxy)-N-(2-methoxyethoxymethyl)-N-methylmethanamine is sourced from PubChem (CID 87640725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).