2-(dimethylamino)ethyl acetate

C6H13NO2 — CID 15013

IUPAC2-(dimethylamino)ethyl acetate
SMILESCC(=O)OCCN(C)C
InChIInChI=1S/C6H13NO2/c1-6(8)9-5-4-7(2)3/h4-5H2,1-3H3
InChIKeyGOLSFPMYASLXJC-UHFFFAOYSA-N
MW131.18 g/mol
LogP0.11
Rot. Bonds3

About 2-(dimethylamino)ethyl acetate

2-(dimethylamino)ethyl acetate (PubChem CID 15013) has the molecular formula C6H13NO2 and a molecular weight of 131.18 g/mol. Its IUPAC name is 2-(dimethylamino)ethyl acetate.

Molecular Properties

Compound Name2-(dimethylamino)ethyl acetate
PubChem CID15013
Molecular FormulaC6H13NO2
Molecular Weight131.18 g/mol
Exact Mass131.09
IUPAC Name2-(dimethylamino)ethyl acetate
SMILESCC(=O)OCCN(C)C
InChIInChI=1S/C6H13NO2/c1-6(8)9-5-4-7(2)3/h4-5H2,1-3H3
InChIKeyGOLSFPMYASLXJC-UHFFFAOYSA-N
XLogP0.11
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.18
LogP ≤ 50.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)ethyl acetate?
The IUPAC name of 2-(dimethylamino)ethyl acetate (CID 15013) is 2-(dimethylamino)ethyl acetate.
What is the SMILES notation for 2-(dimethylamino)ethyl acetate?
The canonical SMILES for 2-(dimethylamino)ethyl acetate is CC(=O)OCCN(C)C.
What is the InChIKey of 2-(dimethylamino)ethyl acetate?
The InChIKey is GOLSFPMYASLXJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2/c1-6(8)9-5-4-7(2)3/h4-5H2,1-3H3.
What are the key properties of 2-(dimethylamino)ethyl acetate?
2-(dimethylamino)ethyl acetate has a molecular weight of 131.18 g/mol, XLogP of 0.11, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)ethyl acetate is sourced from PubChem (CID 15013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).