furan-2-ylmethyl 2-(methylamino)acetate

C8H11NO3 — CID 70320956

IUPACfuran-2-ylmethyl 2-(methylamino)acetate
SMILESCNCC(=O)OCc1ccco1
InChIInChI=1S/C8H11NO3/c1-9-5-8(10)12-6-7-3-2-4-11-7/h2-4,9H,5-6H2,1H3
InChIKeyXAFMWYWFGGKFOJ-UHFFFAOYSA-N
MW169.18 g/mol
LogP0.54
Rot. Bonds4

About furan-2-ylmethyl 2-(methylamino)acetate

furan-2-ylmethyl 2-(methylamino)acetate (PubChem CID 70320956) has the molecular formula C8H11NO3 and a molecular weight of 169.18 g/mol. Its IUPAC name is furan-2-ylmethyl 2-(methylamino)acetate.

Molecular Properties

Compound Namefuran-2-ylmethyl 2-(methylamino)acetate
PubChem CID70320956
Molecular FormulaC8H11NO3
Molecular Weight169.18 g/mol
Exact Mass169.07
IUPAC Namefuran-2-ylmethyl 2-(methylamino)acetate
SMILESCNCC(=O)OCc1ccco1
InChIInChI=1S/C8H11NO3/c1-9-5-8(10)12-6-7-3-2-4-11-7/h2-4,9H,5-6H2,1H3
InChIKeyXAFMWYWFGGKFOJ-UHFFFAOYSA-N
XLogP0.54
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.18
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

furan-2-ylmethyl 2-methoxyacetate
CID 134852986
furan-2-ylmethyl 2-acetylsulfanylacetate
CID 139696753
1-(furan-2-yl)-3-(methylamino)propan-2-one
CID 83635399
furan-2-ylmethyl 5-hydroxy-4-oxopentanoate
CID 174653423
4-O-[3-[4-(furan-2-ylmethoxy)-4-oxobutanoyl]oxy-2,2-bis[[4-(furan-2-ylmethoxy)-4-oxobutanoyl]oxymethyl]propyl] 1-O-(furan-2-ylmethyl) butanedioate
CID 101447383
furan-2-ylmethyl 4-sulfanylbutanoate
CID 89395798
furan-2-ylmethyl 4-(methoxycarbonylamino)butanoate
CID 164839099
2-(furan-2-ylmethoxymethyl)-N-methylprop-2-en-1-amine
CID 103074355
N-(furan-2-ylmethyl)-N-methyl-2-(methylamino)acetamide
CID 43396056
ethyl 2-[[2-(furan-2-yl)acetyl]amino]acetate
CID 110484571
furan-2-ylmethyl prop-2-enoate;hydron
CID 174819627
N-(furan-2-ylmethoxy)-2-methylprop-2-enamide
CID 134839007

Frequently Asked Questions

What is the IUPAC name of furan-2-ylmethyl 2-(methylamino)acetate?
The IUPAC name of furan-2-ylmethyl 2-(methylamino)acetate (CID 70320956) is furan-2-ylmethyl 2-(methylamino)acetate.
What is the SMILES notation for furan-2-ylmethyl 2-(methylamino)acetate?
The canonical SMILES for furan-2-ylmethyl 2-(methylamino)acetate is CNCC(=O)OCc1ccco1.
What is the InChIKey of furan-2-ylmethyl 2-(methylamino)acetate?
The InChIKey is XAFMWYWFGGKFOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO3/c1-9-5-8(10)12-6-7-3-2-4-11-7/h2-4,9H,5-6H2,1H3.
What are the key properties of furan-2-ylmethyl 2-(methylamino)acetate?
furan-2-ylmethyl 2-(methylamino)acetate has a molecular weight of 169.18 g/mol, XLogP of 0.54, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-ylmethyl 2-(methylamino)acetate is sourced from PubChem (CID 70320956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).