2-[2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]phenoxy]acetic acid

C14H16N2O5 — CID 63745847

IUPAC2-[2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]phenoxy]acetic acid
SMILESO=C(O)COc1ccccc1NC(=O)CN1CCCC1=O
InChIInChI=1S/C14H16N2O5/c17-12(8-16-7-3-6-13(16)18)15-10-4-1-2-5-11(10)21-9-14(19)20/h1-2,4-5H,3,6-9H2,(H,15,17)(H,19,20)
InChIKeyXEIBEQQKJIWENW-UHFFFAOYSA-N
MW292.29 g/mol
LogP0.71
Rot. Bonds6

About 2-[2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]phenoxy]acetic acid

2-[2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]phenoxy]acetic acid (PubChem CID 63745847) has the molecular formula C14H16N2O5 and a molecular weight of 292.29 g/mol. Its IUPAC name is 2-[2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]phenoxy]acetic acid.

Molecular Properties

Compound Name2-[2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]phenoxy]acetic acid
PubChem CID63745847
Molecular FormulaC14H16N2O5
Molecular Weight292.29 g/mol
Exact Mass292.11
IUPAC Name2-[2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]phenoxy]acetic acid
SMILESO=C(O)COc1ccccc1NC(=O)CN1CCCC1=O
InChIInChI=1S/C14H16N2O5/c17-12(8-16-7-3-6-13(16)18)15-10-4-1-2-5-11(10)21-9-14(19)20/h1-2,4-5H,3,6-9H2,(H,15,17)(H,19,20)
InChIKeyXEIBEQQKJIWENW-UHFFFAOYSA-N
XLogP0.71
TPSA95.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.29
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-cyclopentyloxyphenyl)-2-(2-oxopiperidin-1-yl)acetamide
CID 78891418
2-[3-[[2-(2-oxoazocan-1-yl)acetyl]amino]phenoxy]acetic acid
CID 119224754
methyl 2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]benzoate
CID 43406096
2-fluoro-6-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]benzoic acid
CID 43442842
N-[2,5-dimethoxy-4-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]phenyl]benzamide
CID 9374401
N-(2-butoxyphenyl)-2-(3,4-dihydro-2H-quinolin-1-yl)acetamide
CID 54817149
2-(2-oxoazepan-1-yl)-N-(2-pyrrolidin-1-ylphenyl)acetamide
CID 30583518
N-(2,4-dimethoxyphenyl)-2-(2-oxopyrrolidin-1-yl)acetamide
CID 47111322
2-(4-oxo-1,3-thiazolidin-3-yl)-N-[2-(2,2,2-trifluoroethoxy)phenyl]acetamide
CID 33372160
2-[2-[(3-methoxy-3-methylbutanoyl)amino]phenoxy]acetic acid
CID 103018697
2-[2-[(3-oxo-3-phenylpropanoyl)amino]phenoxy]acetic acid
CID 35261813
N-(4-fluoro-2-methoxyphenyl)-2-(2-oxopiperidin-1-yl)acetamide
CID 78864389

Frequently Asked Questions

What is the IUPAC name of 2-[2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]phenoxy]acetic acid?
The IUPAC name of 2-[2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]phenoxy]acetic acid (CID 63745847) is 2-[2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]phenoxy]acetic acid.
What is the SMILES notation for 2-[2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]phenoxy]acetic acid?
The canonical SMILES for 2-[2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]phenoxy]acetic acid is O=C(O)COc1ccccc1NC(=O)CN1CCCC1=O.
What is the InChIKey of 2-[2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]phenoxy]acetic acid?
The InChIKey is XEIBEQQKJIWENW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O5/c17-12(8-16-7-3-6-13(16)18)15-10-4-1-2-5-11(10)21-9-14(19)20/h1-2,4-5H,3,6-9H2,(H,15,17)(H,19,20).
What are the key properties of 2-[2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]phenoxy]acetic acid?
2-[2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]phenoxy]acetic acid has a molecular weight of 292.29 g/mol, XLogP of 0.71, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]phenoxy]acetic acid is sourced from PubChem (CID 63745847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).