1-N-(2-methoxyethyl)-1-N-methylpropane-1,2-diamine

C7H18N2O — CID 61427244

IUPAC1-N-(2-methoxyethyl)-1-N-methylpropane-1,2-diamine
SMILESCOCCN(C)CC(C)N
InChIInChI=1S/C7H18N2O/c1-7(8)6-9(2)4-5-10-3/h7H,4-6,8H2,1-3H3
InChIKeyBXODZZYBLSWHPM-UHFFFAOYSA-N
MW146.23 g/mol
LogP-0.09
Rot. Bonds5

About 1-N-(2-methoxyethyl)-1-N-methylpropane-1,2-diamine

1-N-(2-methoxyethyl)-1-N-methylpropane-1,2-diamine (PubChem CID 61427244) has the molecular formula C7H18N2O and a molecular weight of 146.23 g/mol. Its IUPAC name is 1-N-(2-methoxyethyl)-1-N-methylpropane-1,2-diamine.

Molecular Properties

Compound Name1-N-(2-methoxyethyl)-1-N-methylpropane-1,2-diamine
PubChem CID61427244
Molecular FormulaC7H18N2O
Molecular Weight146.23 g/mol
Exact Mass146.14
IUPAC Name1-N-(2-methoxyethyl)-1-N-methylpropane-1,2-diamine
SMILESCOCCN(C)CC(C)N
InChIInChI=1S/C7H18N2O/c1-7(8)6-9(2)4-5-10-3/h7H,4-6,8H2,1-3H3
InChIKeyBXODZZYBLSWHPM-UHFFFAOYSA-N
XLogP-0.09
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 5-0.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-N-(2-methoxyethyl)-1-N-methylpropane-1,2-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-N-(2-methoxyethyl)-1-N-methylpropane-1,2-diamine?
The IUPAC name of 1-N-(2-methoxyethyl)-1-N-methylpropane-1,2-diamine (CID 61427244) is 1-N-(2-methoxyethyl)-1-N-methylpropane-1,2-diamine.
What is the SMILES notation for 1-N-(2-methoxyethyl)-1-N-methylpropane-1,2-diamine?
The canonical SMILES for 1-N-(2-methoxyethyl)-1-N-methylpropane-1,2-diamine is COCCN(C)CC(C)N.
What is the InChIKey of 1-N-(2-methoxyethyl)-1-N-methylpropane-1,2-diamine?
The InChIKey is BXODZZYBLSWHPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N2O/c1-7(8)6-9(2)4-5-10-3/h7H,4-6,8H2,1-3H3.
What are the key properties of 1-N-(2-methoxyethyl)-1-N-methylpropane-1,2-diamine?
1-N-(2-methoxyethyl)-1-N-methylpropane-1,2-diamine has a molecular weight of 146.23 g/mol, XLogP of -0.09, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(2-methoxyethyl)-1-N-methylpropane-1,2-diamine is sourced from PubChem (CID 61427244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).