2-[7-fluoro-4-hydroxy-3-(4-hydroxyphenyl)chromen-4-yl]-N-hydroxyacetamide

C17H14FNO5 — CID 150223692

IUPAC2-[7-fluoro-4-hydroxy-3-(4-hydroxyphenyl)chromen-4-yl]-N-hydroxyacetamide
SMILESO=C(CC1(O)C(c2ccc(O)cc2)=COc2cc(F)ccc21)NO
InChIInChI=1S/C17H14FNO5/c18-11-3-6-13-15(7-11)24-9-14(10-1-4-12(20)5-2-10)17(13,22)8-16(21)19-23/h1-7,9,20,22-23H,8H2,(H,19,21)
InChIKeyFUAFXCVUZINVLP-UHFFFAOYSA-N
MW331.30 g/mol
LogP2.05
Rot. Bonds3

About 2-[7-fluoro-4-hydroxy-3-(4-hydroxyphenyl)chromen-4-yl]-N-hydroxyacetamide

2-[7-fluoro-4-hydroxy-3-(4-hydroxyphenyl)chromen-4-yl]-N-hydroxyacetamide (PubChem CID 150223692) has the molecular formula C17H14FNO5 and a molecular weight of 331.30 g/mol. Its IUPAC name is 2-[7-fluoro-4-hydroxy-3-(4-hydroxyphenyl)chromen-4-yl]-N-hydroxyacetamide.

Molecular Properties

Compound Name2-[7-fluoro-4-hydroxy-3-(4-hydroxyphenyl)chromen-4-yl]-N-hydroxyacetamide
PubChem CID150223692
Molecular FormulaC17H14FNO5
Molecular Weight331.30 g/mol
Exact Mass331.09
IUPAC Name2-[7-fluoro-4-hydroxy-3-(4-hydroxyphenyl)chromen-4-yl]-N-hydroxyacetamide
SMILESO=C(CC1(O)C(c2ccc(O)cc2)=COc2cc(F)ccc21)NO
InChIInChI=1S/C17H14FNO5/c18-11-3-6-13-15(7-11)24-9-14(10-1-4-12(20)5-2-10)17(13,22)8-16(21)19-23/h1-7,9,20,22-23H,8H2,(H,19,21)
InChIKeyFUAFXCVUZINVLP-UHFFFAOYSA-N
XLogP2.05
TPSA99.02 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.30
LogP ≤ 52.05
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-[7-fluoro-4-hydroxy-3-(4-hydroxyphenyl)chromen-4-yl]-N-hydroxyacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[7-fluoro-4-hydroxy-3-(4-hydroxyphenyl)chromen-4-yl]-N-hydroxyacetamide?
The IUPAC name of 2-[7-fluoro-4-hydroxy-3-(4-hydroxyphenyl)chromen-4-yl]-N-hydroxyacetamide (CID 150223692) is 2-[7-fluoro-4-hydroxy-3-(4-hydroxyphenyl)chromen-4-yl]-N-hydroxyacetamide.
What is the SMILES notation for 2-[7-fluoro-4-hydroxy-3-(4-hydroxyphenyl)chromen-4-yl]-N-hydroxyacetamide?
The canonical SMILES for 2-[7-fluoro-4-hydroxy-3-(4-hydroxyphenyl)chromen-4-yl]-N-hydroxyacetamide is O=C(CC1(O)C(c2ccc(O)cc2)=COc2cc(F)ccc21)NO.
What is the InChIKey of 2-[7-fluoro-4-hydroxy-3-(4-hydroxyphenyl)chromen-4-yl]-N-hydroxyacetamide?
The InChIKey is FUAFXCVUZINVLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FNO5/c18-11-3-6-13-15(7-11)24-9-14(10-1-4-12(20)5-2-10)17(13,22)8-16(21)19-23/h1-7,9,20,22-23H,8H2,(H,19,21).
What are the key properties of 2-[7-fluoro-4-hydroxy-3-(4-hydroxyphenyl)chromen-4-yl]-N-hydroxyacetamide?
2-[7-fluoro-4-hydroxy-3-(4-hydroxyphenyl)chromen-4-yl]-N-hydroxyacetamide has a molecular weight of 331.30 g/mol, XLogP of 2.05, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[7-fluoro-4-hydroxy-3-(4-hydroxyphenyl)chromen-4-yl]-N-hydroxyacetamide is sourced from PubChem (CID 150223692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).