2-[[(R)-fluoro(phenyl)methoxy]carbonylamino]acetic acid

C10H10FNO4 — CID 66789213

IUPAC2-[[(R)-fluoro(phenyl)methoxy]carbonylamino]acetic acid
SMILESO=C(O)CNC(=O)O[C@H](F)c1ccccc1
InChIInChI=1S/C10H10FNO4/c11-9(7-4-2-1-3-5-7)16-10(15)12-6-8(13)14/h1-5,9H,6H2,(H,12,15)(H,13,14)/t9-/m0/s1
InChIKeyQNFKBRHZVUEGCL-VIFPVBQESA-N
MW227.19 g/mol
LogP1.47
Rot. Bonds4

About 2-[[(R)-fluoro(phenyl)methoxy]carbonylamino]acetic acid

2-[[(R)-fluoro(phenyl)methoxy]carbonylamino]acetic acid (PubChem CID 66789213) has the molecular formula C10H10FNO4 and a molecular weight of 227.19 g/mol. Its IUPAC name is 2-[[(R)-fluoro(phenyl)methoxy]carbonylamino]acetic acid.

Molecular Properties

Compound Name2-[[(R)-fluoro(phenyl)methoxy]carbonylamino]acetic acid
PubChem CID66789213
Molecular FormulaC10H10FNO4
Molecular Weight227.19 g/mol
Exact Mass227.06
IUPAC Name2-[[(R)-fluoro(phenyl)methoxy]carbonylamino]acetic acid
SMILESO=C(O)CNC(=O)O[C@H](F)c1ccccc1
InChIInChI=1S/C10H10FNO4/c11-9(7-4-2-1-3-5-7)16-10(15)12-6-8(13)14/h1-5,9H,6H2,(H,12,15)(H,13,14)/t9-/m0/s1
InChIKeyQNFKBRHZVUEGCL-VIFPVBQESA-N
XLogP1.47
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.19
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 43445708
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2-(naphthalen-1-yloxycarbonylamino)acetic acid
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2-[[(2R)-2-amino-3-benzhydrylsulfanylpropanoyl]amino]acetic acid
CID 91976170
2-[1-(2-nitrophenyl)ethoxycarbonylamino]acetic acid
CID 19067471
2-[(2,2,2-trifluoro-1-phenylethyl)amino]acetic acid
CID 54593024
acetamide;2-(phenylmethoxycarbonylamino)acetic acid
CID 142382396
[fluoro-[fluoro(phenyl)methoxy]methyl]benzene
CID 57162404
2-[[2-[[2-[(2-benzhydrylsulfanylacetyl)amino]acetyl]amino]acetyl]amino]acetic acid
CID 10693882
1,1,5,5-tetraphenylpentane-2,4-dione
CID 22951899
2-benzamidoacetic acid;hydrofluoride
CID 174760685

Frequently Asked Questions

What is the IUPAC name of 2-[[(R)-fluoro(phenyl)methoxy]carbonylamino]acetic acid?
The IUPAC name of 2-[[(R)-fluoro(phenyl)methoxy]carbonylamino]acetic acid (CID 66789213) is 2-[[(R)-fluoro(phenyl)methoxy]carbonylamino]acetic acid.
What is the SMILES notation for 2-[[(R)-fluoro(phenyl)methoxy]carbonylamino]acetic acid?
The canonical SMILES for 2-[[(R)-fluoro(phenyl)methoxy]carbonylamino]acetic acid is O=C(O)CNC(=O)O[C@H](F)c1ccccc1.
What is the InChIKey of 2-[[(R)-fluoro(phenyl)methoxy]carbonylamino]acetic acid?
The InChIKey is QNFKBRHZVUEGCL-VIFPVBQESA-N. The full InChI is InChI=1S/C10H10FNO4/c11-9(7-4-2-1-3-5-7)16-10(15)12-6-8(13)14/h1-5,9H,6H2,(H,12,15)(H,13,14)/t9-/m0/s1.
What are the key properties of 2-[[(R)-fluoro(phenyl)methoxy]carbonylamino]acetic acid?
2-[[(R)-fluoro(phenyl)methoxy]carbonylamino]acetic acid has a molecular weight of 227.19 g/mol, XLogP of 1.47, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(R)-fluoro(phenyl)methoxy]carbonylamino]acetic acid is sourced from PubChem (CID 66789213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).