methyl 2-(ethylamino)-2-methylpropanoate

C7H15NO2 — CID 43726158

IUPACmethyl 2-(ethylamino)-2-methylpropanoate
SMILESCCNC(C)(C)C(=O)OC
InChIInChI=1S/C7H15NO2/c1-5-8-7(2,3)6(9)10-4/h8H,5H2,1-4H3
InChIKeyACISHZXZCPQMOS-UHFFFAOYSA-N
MW145.20 g/mol
LogP0.55
Rot. Bonds3

About methyl 2-(ethylamino)-2-methylpropanoate

methyl 2-(ethylamino)-2-methylpropanoate (PubChem CID 43726158) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is methyl 2-(ethylamino)-2-methylpropanoate.

Molecular Properties

Compound Namemethyl 2-(ethylamino)-2-methylpropanoate
PubChem CID43726158
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Namemethyl 2-(ethylamino)-2-methylpropanoate
SMILESCCNC(C)(C)C(=O)OC
InChIInChI=1S/C7H15NO2/c1-5-8-7(2,3)6(9)10-4/h8H,5H2,1-4H3
InChIKeyACISHZXZCPQMOS-UHFFFAOYSA-N
XLogP0.55
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze methyl 2-(ethylamino)-2-methylpropanoate 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 methyl 2-(ethylamino)-2-methylpropanoate?
The IUPAC name of methyl 2-(ethylamino)-2-methylpropanoate (CID 43726158) is methyl 2-(ethylamino)-2-methylpropanoate.
What is the SMILES notation for methyl 2-(ethylamino)-2-methylpropanoate?
The canonical SMILES for methyl 2-(ethylamino)-2-methylpropanoate is CCNC(C)(C)C(=O)OC.
What is the InChIKey of methyl 2-(ethylamino)-2-methylpropanoate?
The InChIKey is ACISHZXZCPQMOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2/c1-5-8-7(2,3)6(9)10-4/h8H,5H2,1-4H3.
What are the key properties of methyl 2-(ethylamino)-2-methylpropanoate?
methyl 2-(ethylamino)-2-methylpropanoate has a molecular weight of 145.20 g/mol, XLogP of 0.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(ethylamino)-2-methylpropanoate is sourced from PubChem (CID 43726158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).