2-N-(2-methoxyethyl)-2-methylbutane-2,3-diamine

C8H20N2O — CID 174894244

IUPAC2-N-(2-methoxyethyl)-2-methylbutane-2,3-diamine
SMILESCOCCNC(C)(C)C(C)N
InChIInChI=1S/C8H20N2O/c1-7(9)8(2,3)10-5-6-11-4/h7,10H,5-6,9H2,1-4H3
InChIKeyJUARTVGYPOMGOA-UHFFFAOYSA-N
MW160.26 g/mol
LogP0.35
Rot. Bonds5

About 2-N-(2-methoxyethyl)-2-methylbutane-2,3-diamine

2-N-(2-methoxyethyl)-2-methylbutane-2,3-diamine (PubChem CID 174894244) has the molecular formula C8H20N2O and a molecular weight of 160.26 g/mol. Its IUPAC name is 2-N-(2-methoxyethyl)-2-methylbutane-2,3-diamine.

Molecular Properties

Compound Name2-N-(2-methoxyethyl)-2-methylbutane-2,3-diamine
PubChem CID174894244
Molecular FormulaC8H20N2O
Molecular Weight160.26 g/mol
Exact Mass160.16
IUPAC Name2-N-(2-methoxyethyl)-2-methylbutane-2,3-diamine
SMILESCOCCNC(C)(C)C(C)N
InChIInChI=1S/C8H20N2O/c1-7(9)8(2,3)10-5-6-11-4/h7,10H,5-6,9H2,1-4H3
InChIKeyJUARTVGYPOMGOA-UHFFFAOYSA-N
XLogP0.35
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.26
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-N-(2-methoxyethyl)-2-methylbutane-2,3-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 2-N-(2-methoxyethyl)-2-methylbutane-2,3-diamine?
The IUPAC name of 2-N-(2-methoxyethyl)-2-methylbutane-2,3-diamine (CID 174894244) is 2-N-(2-methoxyethyl)-2-methylbutane-2,3-diamine.
What is the SMILES notation for 2-N-(2-methoxyethyl)-2-methylbutane-2,3-diamine?
The canonical SMILES for 2-N-(2-methoxyethyl)-2-methylbutane-2,3-diamine is COCCNC(C)(C)C(C)N.
What is the InChIKey of 2-N-(2-methoxyethyl)-2-methylbutane-2,3-diamine?
The InChIKey is JUARTVGYPOMGOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2O/c1-7(9)8(2,3)10-5-6-11-4/h7,10H,5-6,9H2,1-4H3.
What are the key properties of 2-N-(2-methoxyethyl)-2-methylbutane-2,3-diamine?
2-N-(2-methoxyethyl)-2-methylbutane-2,3-diamine has a molecular weight of 160.26 g/mol, XLogP of 0.35, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-methoxyethyl)-2-methylbutane-2,3-diamine is sourced from PubChem (CID 174894244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).