N-(2-fluoro-4-hydroxyphenyl)-2-(2-hydroxyphenyl)acetamide

C14H12FNO3 — CID 80740962

IUPACN-(2-fluoro-4-hydroxyphenyl)-2-(2-hydroxyphenyl)acetamide
SMILESO=C(Cc1ccccc1O)Nc1ccc(O)cc1F
InChIInChI=1S/C14H12FNO3/c15-11-8-10(17)5-6-12(11)16-14(19)7-9-3-1-2-4-13(9)18/h1-6,8,17-18H,7H2,(H,16,19)
InChIKeyAKVRQNYKVRSYIU-UHFFFAOYSA-N
MW261.25 g/mol
LogP2.42
Rot. Bonds3

About N-(2-fluoro-4-hydroxyphenyl)-2-(2-hydroxyphenyl)acetamide

N-(2-fluoro-4-hydroxyphenyl)-2-(2-hydroxyphenyl)acetamide (PubChem CID 80740962) has the molecular formula C14H12FNO3 and a molecular weight of 261.25 g/mol. Its IUPAC name is N-(2-fluoro-4-hydroxyphenyl)-2-(2-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-(2-fluoro-4-hydroxyphenyl)-2-(2-hydroxyphenyl)acetamide
PubChem CID80740962
Molecular FormulaC14H12FNO3
Molecular Weight261.25 g/mol
Exact Mass261.08
IUPAC NameN-(2-fluoro-4-hydroxyphenyl)-2-(2-hydroxyphenyl)acetamide
SMILESO=C(Cc1ccccc1O)Nc1ccc(O)cc1F
InChIInChI=1S/C14H12FNO3/c15-11-8-10(17)5-6-12(11)16-14(19)7-9-3-1-2-4-13(9)18/h1-6,8,17-18H,7H2,(H,16,19)
InChIKeyAKVRQNYKVRSYIU-UHFFFAOYSA-N
XLogP2.42
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.25
LogP ≤ 52.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

2-(2-hydroxyphenyl)-N-(2,4,5-trifluorophenyl)acetamide
CID 80741188
N-(2-fluoro-4-hydroxyphenyl)-2-pyridin-4-ylacetamide
CID 64795370
N-(3-fluoro-4-pyridinyl)-2-(2-hydroxyphenyl)acetamide
CID 113342447
2-(2,4-dihydroxyphenyl)-N-(2,5-dihydroxyphenyl)acetamide
CID 131978402
2-(3,4-dimethylphenyl)-N-(2-fluoro-4-hydroxyphenyl)acetamide
CID 64792942
2-(2-bromophenyl)-N-(2,4-difluorophenyl)acetamide
CID 113098832
3-amino-4-[[2-(2-hydroxyphenyl)acetyl]amino]benzoic acid
CID 80744121
N-(2-cyano-3-fluorophenyl)-2-(2-hydroxyphenyl)acetamide
CID 80740497
2-(2,5-dihydroxyphenyl)-N-[4-[[2-(2,5-dihydroxyphenyl)acetyl]amino]-9,10-dioxoanthracen-1-yl]acetamide
CID 154128556
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(2-fluoro-4-hydroxyphenyl)acetamide
CID 86787189
N-(4-bromo-2-chlorophenyl)-2-(2-hydroxyphenyl)acetamide
CID 80741026
N-(2-fluoro-4-hydroxyphenyl)-2-phenylpropanamide
CID 104920662

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-4-hydroxyphenyl)-2-(2-hydroxyphenyl)acetamide?
The IUPAC name of N-(2-fluoro-4-hydroxyphenyl)-2-(2-hydroxyphenyl)acetamide (CID 80740962) is N-(2-fluoro-4-hydroxyphenyl)-2-(2-hydroxyphenyl)acetamide.
What is the SMILES notation for N-(2-fluoro-4-hydroxyphenyl)-2-(2-hydroxyphenyl)acetamide?
The canonical SMILES for N-(2-fluoro-4-hydroxyphenyl)-2-(2-hydroxyphenyl)acetamide is O=C(Cc1ccccc1O)Nc1ccc(O)cc1F.
What is the InChIKey of N-(2-fluoro-4-hydroxyphenyl)-2-(2-hydroxyphenyl)acetamide?
The InChIKey is AKVRQNYKVRSYIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FNO3/c15-11-8-10(17)5-6-12(11)16-14(19)7-9-3-1-2-4-13(9)18/h1-6,8,17-18H,7H2,(H,16,19).
What are the key properties of N-(2-fluoro-4-hydroxyphenyl)-2-(2-hydroxyphenyl)acetamide?
N-(2-fluoro-4-hydroxyphenyl)-2-(2-hydroxyphenyl)acetamide has a molecular weight of 261.25 g/mol, XLogP of 2.42, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-4-hydroxyphenyl)-2-(2-hydroxyphenyl)acetamide is sourced from PubChem (CID 80740962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).