2-[2-[methanidyl(methyl)amino]ethoxy]ethanamine

C6H15N2O- — CID 91305117

IUPAC2-[2-[methanidyl(methyl)amino]ethoxy]ethanamine
SMILES[CH2-]N(C)CCOCCN
InChIInChI=1S/C6H15N2O/c1-8(2)4-6-9-5-3-7/h1,3-7H2,2H3/q-1
InChIKeyTTZSIVKRIQELSM-UHFFFAOYSA-N
MW131.20 g/mol
LogP-0.31
Rot. Bonds5

About 2-[2-[methanidyl(methyl)amino]ethoxy]ethanamine

2-[2-[methanidyl(methyl)amino]ethoxy]ethanamine (PubChem CID 91305117) has the molecular formula C6H15N2O- and a molecular weight of 131.20 g/mol. Its IUPAC name is 2-[2-[methanidyl(methyl)amino]ethoxy]ethanamine.

Molecular Properties

Compound Name2-[2-[methanidyl(methyl)amino]ethoxy]ethanamine
PubChem CID91305117
Molecular FormulaC6H15N2O-
Molecular Weight131.20 g/mol
Exact Mass131.12
IUPAC Name2-[2-[methanidyl(methyl)amino]ethoxy]ethanamine
SMILES[CH2-]N(C)CCOCCN
InChIInChI=1S/C6H15N2O/c1-8(2)4-6-9-5-3-7/h1,3-7H2,2H3/q-1
InChIKeyTTZSIVKRIQELSM-UHFFFAOYSA-N
XLogP-0.31
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.20
LogP ≤ 5-0.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze 2-[2-[methanidyl(methyl)amino]ethoxy]ethanamine with MolForge

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

Launch Full Analysis

Related Compounds

2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethanamine
CID 58108235
3-(2-aminoethoxy)-N,N-dimethylpropan-1-amine
CID 56993773
2-(2-aminoethoxy)ethanamine;azane
CID 87273439
2-(2-aminoethoxy)ethanamine;hydron;dichloride
CID 74764781
2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanamine;azane
CID 174533279
N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-N-methylpropanamide
CID 168897621
3-(2-aminoethoxy)-N-methyl-N-propylpropan-1-amine
CID 171838408
N,N-bis[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]butan-1-amine
CID 134252027
3-[2-(2-aminoethoxy)ethyl-methylamino]-4-methylcyclobut-3-ene-1,2-dione
CID 155278234
N-[2-(2-aminoethoxy)ethyl]-2-methyl-N-propan-2-ylpropan-1-amine
CID 79478830
2-[bis[2-[2-(2-aminoethoxy)ethoxy]ethyl]amino]ethanol
CID 59518679
CID 176727323
CID 176727323

Frequently Asked Questions

What is the IUPAC name of 2-[2-[methanidyl(methyl)amino]ethoxy]ethanamine?
The IUPAC name of 2-[2-[methanidyl(methyl)amino]ethoxy]ethanamine (CID 91305117) is 2-[2-[methanidyl(methyl)amino]ethoxy]ethanamine.
What is the SMILES notation for 2-[2-[methanidyl(methyl)amino]ethoxy]ethanamine?
The canonical SMILES for 2-[2-[methanidyl(methyl)amino]ethoxy]ethanamine is [CH2-]N(C)CCOCCN.
What is the InChIKey of 2-[2-[methanidyl(methyl)amino]ethoxy]ethanamine?
The InChIKey is TTZSIVKRIQELSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N2O/c1-8(2)4-6-9-5-3-7/h1,3-7H2,2H3/q-1.
What are the key properties of 2-[2-[methanidyl(methyl)amino]ethoxy]ethanamine?
2-[2-[methanidyl(methyl)amino]ethoxy]ethanamine has a molecular weight of 131.20 g/mol, XLogP of -0.31, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[methanidyl(methyl)amino]ethoxy]ethanamine is sourced from PubChem (CID 91305117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).