methyl (2R)-2-amino-2-(furan-3-yl)acetate

C7H9NO3 — CID 130841442

IUPACmethyl (2R)-2-amino-2-(furan-3-yl)acetate
SMILESCOC(=O)[C@H](N)c1ccoc1
InChIInChI=1S/C7H9NO3/c1-10-7(9)6(8)5-2-3-11-4-5/h2-4,6H,8H2,1H3/t6-/m1/s1
InChIKeyGANHVIBOMQZCLN-ZCFIWIBFSA-N
MW155.15 g/mol
LogP0.45
Rot. Bonds2

About methyl (2R)-2-amino-2-(furan-3-yl)acetate

methyl (2R)-2-amino-2-(furan-3-yl)acetate (PubChem CID 130841442) has the molecular formula C7H9NO3 and a molecular weight of 155.15 g/mol. Its IUPAC name is methyl (2R)-2-amino-2-(furan-3-yl)acetate.

Molecular Properties

Compound Namemethyl (2R)-2-amino-2-(furan-3-yl)acetate
PubChem CID130841442
Molecular FormulaC7H9NO3
Molecular Weight155.15 g/mol
Exact Mass155.06
IUPAC Namemethyl (2R)-2-amino-2-(furan-3-yl)acetate
SMILESCOC(=O)[C@H](N)c1ccoc1
InChIInChI=1S/C7H9NO3/c1-10-7(9)6(8)5-2-3-11-4-5/h2-4,6H,8H2,1H3/t6-/m1/s1
InChIKeyGANHVIBOMQZCLN-ZCFIWIBFSA-N
XLogP0.45
TPSA65.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.15
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-2-(furan-3-yl)acetic acid
CID 4564162
methyl 3-(furan-3-yl)-2-methyl-3-sulfanylpropanoate
CID 20649170
methyl (3S)-3-amino-3-(furan-3-yl)-2,2-dimethylpropanoate
CID 171250455
methyl 4-amino-3-(furan-3-yl)hexanoate
CID 66097088
methyl 4-amino-3-(furan-3-yl)butanoate
CID 66096201
2-(furan-3-yl)propanamide
CID 140988515
furan-3-ylmethanediamine
CID 54545098
methyl 4-(1-amino-2-methoxy-2-oxoethyl)benzoate
CID 10082311
1-(furan-3-yl)-2-methoxyethanamine
CID 63948777
ethyl 2-fluoro-2-(furan-3-yl)acetate
CID 79366156
methyl 2-fluoro-3-(furan-3-yl)-3-oxopropanoate
CID 102234104
2-amino-3-(furan-3-yl)-3-hydroxypropanoic acid
CID 66207169

Frequently Asked Questions

What is the IUPAC name of methyl (2R)-2-amino-2-(furan-3-yl)acetate?
The IUPAC name of methyl (2R)-2-amino-2-(furan-3-yl)acetate (CID 130841442) is methyl (2R)-2-amino-2-(furan-3-yl)acetate.
What is the SMILES notation for methyl (2R)-2-amino-2-(furan-3-yl)acetate?
The canonical SMILES for methyl (2R)-2-amino-2-(furan-3-yl)acetate is COC(=O)[C@H](N)c1ccoc1.
What is the InChIKey of methyl (2R)-2-amino-2-(furan-3-yl)acetate?
The InChIKey is GANHVIBOMQZCLN-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H9NO3/c1-10-7(9)6(8)5-2-3-11-4-5/h2-4,6H,8H2,1H3/t6-/m1/s1.
What are the key properties of methyl (2R)-2-amino-2-(furan-3-yl)acetate?
methyl (2R)-2-amino-2-(furan-3-yl)acetate has a molecular weight of 155.15 g/mol, XLogP of 0.45, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl (2R)-2-amino-2-(furan-3-yl)acetate is sourced from PubChem (CID 130841442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).