2-[(9-oxofluorene-4-carbonyl)amino]acetic acid

C16H11NO4 — CID 165416264

IUPAC2-[(9-oxofluorene-4-carbonyl)amino]acetic acid
SMILESO=C(O)CNC(=O)c1cccc2c1-c1ccccc1C2=O
InChIInChI=1S/C16H11NO4/c18-13(19)8-17-16(21)12-7-3-6-11-14(12)9-4-1-2-5-10(9)15(11)20/h1-7H,8H2,(H,17,21)(H,18,19)
InChIKeyXIDITRUNIYHCDR-UHFFFAOYSA-N
MW281.27 g/mol
LogP1.71
Rot. Bonds3

About 2-[(9-oxofluorene-4-carbonyl)amino]acetic acid

2-[(9-oxofluorene-4-carbonyl)amino]acetic acid (PubChem CID 165416264) has the molecular formula C16H11NO4 and a molecular weight of 281.27 g/mol. Its IUPAC name is 2-[(9-oxofluorene-4-carbonyl)amino]acetic acid.

Molecular Properties

Compound Name2-[(9-oxofluorene-4-carbonyl)amino]acetic acid
PubChem CID165416264
Molecular FormulaC16H11NO4
Molecular Weight281.27 g/mol
Exact Mass281.07
IUPAC Name2-[(9-oxofluorene-4-carbonyl)amino]acetic acid
SMILESO=C(O)CNC(=O)c1cccc2c1-c1ccccc1C2=O
InChIInChI=1S/C16H11NO4/c18-13(19)8-17-16(21)12-7-3-6-11-14(12)9-4-1-2-5-10(9)15(11)20/h1-7H,8H2,(H,17,21)(H,18,19)
InChIKeyXIDITRUNIYHCDR-UHFFFAOYSA-N
XLogP1.71
TPSA83.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.27
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(9-oxofluorene-4-carbonyl)amino]acetic acid?
The IUPAC name of 2-[(9-oxofluorene-4-carbonyl)amino]acetic acid (CID 165416264) is 2-[(9-oxofluorene-4-carbonyl)amino]acetic acid.
What is the SMILES notation for 2-[(9-oxofluorene-4-carbonyl)amino]acetic acid?
The canonical SMILES for 2-[(9-oxofluorene-4-carbonyl)amino]acetic acid is O=C(O)CNC(=O)c1cccc2c1-c1ccccc1C2=O.
What is the InChIKey of 2-[(9-oxofluorene-4-carbonyl)amino]acetic acid?
The InChIKey is XIDITRUNIYHCDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11NO4/c18-13(19)8-17-16(21)12-7-3-6-11-14(12)9-4-1-2-5-10(9)15(11)20/h1-7H,8H2,(H,17,21)(H,18,19).
What are the key properties of 2-[(9-oxofluorene-4-carbonyl)amino]acetic acid?
2-[(9-oxofluorene-4-carbonyl)amino]acetic acid has a molecular weight of 281.27 g/mol, XLogP of 1.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(9-oxofluorene-4-carbonyl)amino]acetic acid is sourced from PubChem (CID 165416264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).