N,N-dimethylaniline;ethyl 2-aminoacetate

C12H20N2O2 — CID 174495467

IUPACN,N-dimethylaniline;ethyl 2-aminoacetate
SMILESCCOC(=O)CN.CN(C)c1ccccc1
InChIInChI=1S/C8H11N.C4H9NO2/c1-9(2)8-6-4-3-5-7-8;1-2-7-4(6)3-5/h3-7H,1-2H3;2-3,5H2,1H3
InChIKeyGHFNUUQHEMPWRA-UHFFFAOYSA-N
MW224.30 g/mol
LogP1.26
Rot. Bonds3

About N,N-dimethylaniline;ethyl 2-aminoacetate

N,N-dimethylaniline;ethyl 2-aminoacetate (PubChem CID 174495467) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is N,N-dimethylaniline;ethyl 2-aminoacetate.

Molecular Properties

Compound NameN,N-dimethylaniline;ethyl 2-aminoacetate
PubChem CID174495467
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC NameN,N-dimethylaniline;ethyl 2-aminoacetate
SMILESCCOC(=O)CN.CN(C)c1ccccc1
InChIInChI=1S/C8H11N.C4H9NO2/c1-9(2)8-6-4-3-5-7-8;1-2-7-4(6)3-5/h3-7H,1-2H3;2-3,5H2,1H3
InChIKeyGHFNUUQHEMPWRA-UHFFFAOYSA-N
XLogP1.26
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethylaniline;ethyl 2-aminoacetate?
The IUPAC name of N,N-dimethylaniline;ethyl 2-aminoacetate (CID 174495467) is N,N-dimethylaniline;ethyl 2-aminoacetate.
What is the SMILES notation for N,N-dimethylaniline;ethyl 2-aminoacetate?
The canonical SMILES for N,N-dimethylaniline;ethyl 2-aminoacetate is CCOC(=O)CN.CN(C)c1ccccc1.
What is the InChIKey of N,N-dimethylaniline;ethyl 2-aminoacetate?
The InChIKey is GHFNUUQHEMPWRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N.C4H9NO2/c1-9(2)8-6-4-3-5-7-8;1-2-7-4(6)3-5/h3-7H,1-2H3;2-3,5H2,1H3.
What are the key properties of N,N-dimethylaniline;ethyl 2-aminoacetate?
N,N-dimethylaniline;ethyl 2-aminoacetate has a molecular weight of 224.30 g/mol, XLogP of 1.26, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylaniline;ethyl 2-aminoacetate is sourced from PubChem (CID 174495467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).