ethyl 2-[[furan-3-ylmethyl(methyl)carbamoyl]amino]acetate

C11H16N2O4 — CID 47337990

IUPACethyl 2-[[furan-3-ylmethyl(methyl)carbamoyl]amino]acetate
SMILESCCOC(=O)CNC(=O)N(C)Cc1ccoc1
InChIInChI=1S/C11H16N2O4/c1-3-17-10(14)6-12-11(15)13(2)7-9-4-5-16-8-9/h4-5,8H,3,6-7H2,1-2H3,(H,12,15)
InChIKeyHBEFNUWJYLVGPO-UHFFFAOYSA-N
MW240.26 g/mol
LogP0.98
Rot. Bonds5

About ethyl 2-[[furan-3-ylmethyl(methyl)carbamoyl]amino]acetate

ethyl 2-[[furan-3-ylmethyl(methyl)carbamoyl]amino]acetate (PubChem CID 47337990) has the molecular formula C11H16N2O4 and a molecular weight of 240.26 g/mol. Its IUPAC name is ethyl 2-[[furan-3-ylmethyl(methyl)carbamoyl]amino]acetate.

Molecular Properties

Compound Nameethyl 2-[[furan-3-ylmethyl(methyl)carbamoyl]amino]acetate
PubChem CID47337990
Molecular FormulaC11H16N2O4
Molecular Weight240.26 g/mol
Exact Mass240.11
IUPAC Nameethyl 2-[[furan-3-ylmethyl(methyl)carbamoyl]amino]acetate
SMILESCCOC(=O)CNC(=O)N(C)Cc1ccoc1
InChIInChI=1S/C11H16N2O4/c1-3-17-10(14)6-12-11(15)13(2)7-9-4-5-16-8-9/h4-5,8H,3,6-7H2,1-2H3,(H,12,15)
InChIKeyHBEFNUWJYLVGPO-UHFFFAOYSA-N
XLogP0.98
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze ethyl 2-[[furan-3-ylmethyl(methyl)carbamoyl]amino]acetate 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

ethyl 2-[[methyl-[(2-methylfuran-3-yl)methyl]carbamoyl]amino]acetate
CID 47377436
1-(furan-3-ylmethyl)-3-hydroxy-1-methylurea
CID 54330793
2-[[[furan-3-ylmethyl(methyl)carbamoyl]amino]methyl]butanoic acid
CID 65223341
(2S)-3-[[furan-3-ylmethyl(methyl)carbamoyl]amino]-2-hydroxypropanoic acid
CID 107838816
ethyl 2-[[(5-bromothiophen-3-yl)methyl-methylcarbamoyl]amino]acetate
CID 47390511
ethyl 2-[furan-3-ylmethyl(propyl)amino]acetate
CID 83057034
ethyl 2-[[(2-chlorophenyl)methyl-methylcarbamoyl]amino]acetate
CID 47103192
1-[[[furan-3-ylmethyl(methyl)carbamoyl]amino]methyl]cyclopropane-1-carboxylic acid
CID 115451347
3-[[[furan-3-ylmethyl(methyl)carbamoyl]amino]methyl]benzoic acid
CID 61422425
N-(furan-3-ylmethyl)-N,3,3-trimethylbutanamide
CID 110868951
ethyl 2-[benzyl(furan-3-ylmethyl)amino]acetate
CID 5151384
N-(furan-3-ylmethyl)-N,4-dimethylbenzamide
CID 110868919

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[[furan-3-ylmethyl(methyl)carbamoyl]amino]acetate?
The IUPAC name of ethyl 2-[[furan-3-ylmethyl(methyl)carbamoyl]amino]acetate (CID 47337990) is ethyl 2-[[furan-3-ylmethyl(methyl)carbamoyl]amino]acetate.
What is the SMILES notation for ethyl 2-[[furan-3-ylmethyl(methyl)carbamoyl]amino]acetate?
The canonical SMILES for ethyl 2-[[furan-3-ylmethyl(methyl)carbamoyl]amino]acetate is CCOC(=O)CNC(=O)N(C)Cc1ccoc1.
What is the InChIKey of ethyl 2-[[furan-3-ylmethyl(methyl)carbamoyl]amino]acetate?
The InChIKey is HBEFNUWJYLVGPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O4/c1-3-17-10(14)6-12-11(15)13(2)7-9-4-5-16-8-9/h4-5,8H,3,6-7H2,1-2H3,(H,12,15).
What are the key properties of ethyl 2-[[furan-3-ylmethyl(methyl)carbamoyl]amino]acetate?
ethyl 2-[[furan-3-ylmethyl(methyl)carbamoyl]amino]acetate has a molecular weight of 240.26 g/mol, XLogP of 0.98, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[[furan-3-ylmethyl(methyl)carbamoyl]amino]acetate is sourced from PubChem (CID 47337990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).