ethyl 2-acetamido-2-(furan-2-yl)acetate

C10H13NO4 — CID 14212852

IUPACethyl 2-acetamido-2-(furan-2-yl)acetate
SMILESCCOC(=O)C(NC(C)=O)c1ccco1
InChIInChI=1S/C10H13NO4/c1-3-14-10(13)9(11-7(2)12)8-5-4-6-15-8/h4-6,9H,3H2,1-2H3,(H,11,12)
InChIKeyWDWZTPJIGVXIJY-UHFFFAOYSA-N
MW211.22 g/mol
LogP1.02
Rot. Bonds4

About ethyl 2-acetamido-2-(furan-2-yl)acetate

ethyl 2-acetamido-2-(furan-2-yl)acetate (PubChem CID 14212852) has the molecular formula C10H13NO4 and a molecular weight of 211.22 g/mol. Its IUPAC name is ethyl 2-acetamido-2-(furan-2-yl)acetate.

Molecular Properties

Compound Nameethyl 2-acetamido-2-(furan-2-yl)acetate
PubChem CID14212852
Molecular FormulaC10H13NO4
Molecular Weight211.22 g/mol
Exact Mass211.08
IUPAC Nameethyl 2-acetamido-2-(furan-2-yl)acetate
SMILESCCOC(=O)C(NC(C)=O)c1ccco1
InChIInChI=1S/C10H13NO4/c1-3-14-10(13)9(11-7(2)12)8-5-4-6-15-8/h4-6,9H,3H2,1-2H3,(H,11,12)
InChIKeyWDWZTPJIGVXIJY-UHFFFAOYSA-N
XLogP1.02
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.22
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl N-[(1S)-1-(furan-2-yl)ethyl]carbamate
CID 81401192
ethyl N-[1-(furan-2-yl)ethyl]carbamate
CID 60660951
ethyl 2-[[(1S)-1-(furan-2-yl)ethyl]amino]-2-phenylacetate
CID 106677258
ethyl 2-[1-(furan-2-yl)ethylamino]-2-phenylacetate
CID 103604487
ethyl (3S)-3-(furan-2-yl)-3-(hydroxyamino)propanoate
CID 125473077
ethyl 2-[1-(furan-2-yl)ethylamino]propanoate
CID 61498285
ethyl (2S)-2-acetamido-2-(4-hydroxyphenyl)acetate
CID 93477748
N-[1-(furan-2-yl)ethyl]acetamide
CID 22460009
diethyl 2-[(1S)-1-(furan-2-yl)-3-oxobutyl]propanedioate
CID 12966059
ethyl 2-(furan-2-ylmethylamino)butanoate
CID 64667944
(2R)-2-acetamido-N-[(3-fluorophenyl)methyl]-2-(furan-2-yl)acetamide
CID 25031587
ethyl 2-amino-3-(furan-2-yl)propanoate
CID 22608494

Frequently Asked Questions

What is the IUPAC name of ethyl 2-acetamido-2-(furan-2-yl)acetate?
The IUPAC name of ethyl 2-acetamido-2-(furan-2-yl)acetate (CID 14212852) is ethyl 2-acetamido-2-(furan-2-yl)acetate.
What is the SMILES notation for ethyl 2-acetamido-2-(furan-2-yl)acetate?
The canonical SMILES for ethyl 2-acetamido-2-(furan-2-yl)acetate is CCOC(=O)C(NC(C)=O)c1ccco1.
What is the InChIKey of ethyl 2-acetamido-2-(furan-2-yl)acetate?
The InChIKey is WDWZTPJIGVXIJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO4/c1-3-14-10(13)9(11-7(2)12)8-5-4-6-15-8/h4-6,9H,3H2,1-2H3,(H,11,12).
What are the key properties of ethyl 2-acetamido-2-(furan-2-yl)acetate?
ethyl 2-acetamido-2-(furan-2-yl)acetate has a molecular weight of 211.22 g/mol, XLogP of 1.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-acetamido-2-(furan-2-yl)acetate is sourced from PubChem (CID 14212852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).