[2-(methylamino)-2-oxoethyl] 3-(furan-2-yl)propanoate

C10H13NO4 — CID 78763973

IUPAC[2-(methylamino)-2-oxoethyl] 3-(furan-2-yl)propanoate
SMILESCNC(=O)COC(=O)CCc1ccco1
InChIInChI=1S/C10H13NO4/c1-11-9(12)7-15-10(13)5-4-8-3-2-6-14-8/h2-3,6H,4-5,7H2,1H3,(H,11,12)
InChIKeyLCGKPZKUMADENU-UHFFFAOYSA-N
MW211.22 g/mol
LogP0.50
Rot. Bonds5

About [2-(methylamino)-2-oxoethyl] 3-(furan-2-yl)propanoate

[2-(methylamino)-2-oxoethyl] 3-(furan-2-yl)propanoate (PubChem CID 78763973) has the molecular formula C10H13NO4 and a molecular weight of 211.22 g/mol. Its IUPAC name is [2-(methylamino)-2-oxoethyl] 3-(furan-2-yl)propanoate.

Molecular Properties

Compound Name[2-(methylamino)-2-oxoethyl] 3-(furan-2-yl)propanoate
PubChem CID78763973
Molecular FormulaC10H13NO4
Molecular Weight211.22 g/mol
Exact Mass211.08
IUPAC Name[2-(methylamino)-2-oxoethyl] 3-(furan-2-yl)propanoate
SMILESCNC(=O)COC(=O)CCc1ccco1
InChIInChI=1S/C10H13NO4/c1-11-9(12)7-15-10(13)5-4-8-3-2-6-14-8/h2-3,6H,4-5,7H2,1H3,(H,11,12)
InChIKeyLCGKPZKUMADENU-UHFFFAOYSA-N
XLogP0.50
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.22
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [2-(methylamino)-2-oxoethyl] 3-(furan-2-yl)propanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-bromoethyl 3-(furan-2-yl)propanoate
CID 174386659
tert-butyl 3-(furan-2-yl)propanoate
CID 63897010
ethyl 5-(furan-2-yl)-3-oxopentanoate
CID 10846117
N-(1-amino-2-methylpropan-2-yl)-3-(furan-2-yl)propanamide
CID 63193685
3-(furan-2-yl)-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]propanamide
CID 38404476
N-ethyl-3-(furan-2-yl)propanamide
CID 60690706
[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] 3-(4-methoxyphenyl)propanoate
CID 2523204
[2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl] 3-(furan-2-yl)propanoate
CID 30017533
[2-[4-[methyl(methylsulfonyl)amino]phenyl]-2-oxoethyl] 3-(furan-2-yl)propanoate
CID 9487434
[2-(furan-2-ylmethylamino)-2-oxoethyl] 6-(carbamoylamino)hexanoate
CID 8859315
6-(furan-2-yl)hexane-2,4-dione
CID 155288881
3-(furan-2-yl)-N-(2-oxopropyl)propanamide
CID 64996773

Frequently Asked Questions

What is the IUPAC name of [2-(methylamino)-2-oxoethyl] 3-(furan-2-yl)propanoate?
The IUPAC name of [2-(methylamino)-2-oxoethyl] 3-(furan-2-yl)propanoate (CID 78763973) is [2-(methylamino)-2-oxoethyl] 3-(furan-2-yl)propanoate.
What is the SMILES notation for [2-(methylamino)-2-oxoethyl] 3-(furan-2-yl)propanoate?
The canonical SMILES for [2-(methylamino)-2-oxoethyl] 3-(furan-2-yl)propanoate is CNC(=O)COC(=O)CCc1ccco1.
What is the InChIKey of [2-(methylamino)-2-oxoethyl] 3-(furan-2-yl)propanoate?
The InChIKey is LCGKPZKUMADENU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO4/c1-11-9(12)7-15-10(13)5-4-8-3-2-6-14-8/h2-3,6H,4-5,7H2,1H3,(H,11,12).
What are the key properties of [2-(methylamino)-2-oxoethyl] 3-(furan-2-yl)propanoate?
[2-(methylamino)-2-oxoethyl] 3-(furan-2-yl)propanoate has a molecular weight of 211.22 g/mol, XLogP of 0.50, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(methylamino)-2-oxoethyl] 3-(furan-2-yl)propanoate is sourced from PubChem (CID 78763973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).