N-ethoxy-2-methylpropan-2-amine

C6H15NO — CID 20626712

IUPACN-ethoxy-2-methylpropan-2-amine
SMILESCCONC(C)(C)C
InChIInChI=1S/C6H15NO/c1-5-8-7-6(2,3)4/h7H,5H2,1-4H3
InChIKeyYPOVDCYMBVIROJ-UHFFFAOYSA-N
MW117.19 g/mol
LogP1.33
Rot. Bonds2

About N-ethoxy-2-methylpropan-2-amine

N-ethoxy-2-methylpropan-2-amine (PubChem CID 20626712) has the molecular formula C6H15NO and a molecular weight of 117.19 g/mol. Its IUPAC name is N-ethoxy-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-ethoxy-2-methylpropan-2-amine
PubChem CID20626712
Molecular FormulaC6H15NO
Molecular Weight117.19 g/mol
Exact Mass117.12
IUPAC NameN-ethoxy-2-methylpropan-2-amine
SMILESCCONC(C)(C)C
InChIInChI=1S/C6H15NO/c1-5-8-7-6(2,3)4/h7H,5H2,1-4H3
InChIKeyYPOVDCYMBVIROJ-UHFFFAOYSA-N
XLogP1.33
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.19
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-ethoxy-2-methylpropan-2-amine 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 N-ethoxy-2-methylpropan-2-amine?
The IUPAC name of N-ethoxy-2-methylpropan-2-amine (CID 20626712) is N-ethoxy-2-methylpropan-2-amine.
What is the SMILES notation for N-ethoxy-2-methylpropan-2-amine?
The canonical SMILES for N-ethoxy-2-methylpropan-2-amine is CCONC(C)(C)C.
What is the InChIKey of N-ethoxy-2-methylpropan-2-amine?
The InChIKey is YPOVDCYMBVIROJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO/c1-5-8-7-6(2,3)4/h7H,5H2,1-4H3.
What are the key properties of N-ethoxy-2-methylpropan-2-amine?
N-ethoxy-2-methylpropan-2-amine has a molecular weight of 117.19 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethoxy-2-methylpropan-2-amine is sourced from PubChem (CID 20626712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).