2-(5-fluoro-2-hydroxyphenyl)-2-(4-methylanilino)acetamide

C15H15FN2O2 — CID 107698125

IUPAC2-(5-fluoro-2-hydroxyphenyl)-2-(4-methylanilino)acetamide
SMILESCc1ccc(NC(C(N)=O)c2cc(F)ccc2O)cc1
InChIInChI=1S/C15H15FN2O2/c1-9-2-5-11(6-3-9)18-14(15(17)20)12-8-10(16)4-7-13(12)19/h2-8,14,18-19H,1H3,(H2,17,20)
InChIKeyZPDSRMWHCXUFAX-UHFFFAOYSA-N
MW274.30 g/mol
LogP2.48
Rot. Bonds4

About 2-(5-fluoro-2-hydroxyphenyl)-2-(4-methylanilino)acetamide

2-(5-fluoro-2-hydroxyphenyl)-2-(4-methylanilino)acetamide (PubChem CID 107698125) has the molecular formula C15H15FN2O2 and a molecular weight of 274.30 g/mol. Its IUPAC name is 2-(5-fluoro-2-hydroxyphenyl)-2-(4-methylanilino)acetamide.

Molecular Properties

Compound Name2-(5-fluoro-2-hydroxyphenyl)-2-(4-methylanilino)acetamide
PubChem CID107698125
Molecular FormulaC15H15FN2O2
Molecular Weight274.30 g/mol
Exact Mass274.11
IUPAC Name2-(5-fluoro-2-hydroxyphenyl)-2-(4-methylanilino)acetamide
SMILESCc1ccc(NC(C(N)=O)c2cc(F)ccc2O)cc1
InChIInChI=1S/C15H15FN2O2/c1-9-2-5-11(6-3-9)18-14(15(17)20)12-8-10(16)4-7-13(12)19/h2-8,14,18-19H,1H3,(H2,17,20)
InChIKeyZPDSRMWHCXUFAX-UHFFFAOYSA-N
XLogP2.48
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 52.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

(2R)-2-(4-fluorophenyl)-2-(4-methylanilino)acetamide
CID 93381369
2-(3-fluoro-4-hydroxyphenyl)-2-(4-methylanilino)acetamide
CID 107686167
2-(5-fluoro-2-hydroxyphenyl)-2-(propylamino)acetamide
CID 107698118
2-anilino-2-(4-fluoro-2-methylphenyl)acetamide
CID 62135663
2-(2-bromoanilino)-2-(5-fluoro-2-hydroxyphenyl)acetamide
CID 107698134
2-(2,5-difluorophenyl)-2-(3-methylanilino)acetamide
CID 61005085
2-(4-methylanilino)-2-(2,4,6-trimethylphenyl)acetamide
CID 61005259
2-anilino-2-(2,4-difluorophenyl)acetamide
CID 54889357
2-[4-(difluoromethyl)phenyl]-2-(4-methylanilino)acetamide
CID 115524448
2-(5-fluoro-2-hydroxyphenyl)-2-(propan-2-ylamino)acetic acid
CID 107698106
methyl 2-(4-fluoroanilino)-2-(4-methylphenyl)acetate
CID 60991414
2-(5-bromo-2-fluorophenyl)-2-(4-fluoroanilino)acetamide
CID 61004958

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-2-hydroxyphenyl)-2-(4-methylanilino)acetamide?
The IUPAC name of 2-(5-fluoro-2-hydroxyphenyl)-2-(4-methylanilino)acetamide (CID 107698125) is 2-(5-fluoro-2-hydroxyphenyl)-2-(4-methylanilino)acetamide.
What is the SMILES notation for 2-(5-fluoro-2-hydroxyphenyl)-2-(4-methylanilino)acetamide?
The canonical SMILES for 2-(5-fluoro-2-hydroxyphenyl)-2-(4-methylanilino)acetamide is Cc1ccc(NC(C(N)=O)c2cc(F)ccc2O)cc1.
What is the InChIKey of 2-(5-fluoro-2-hydroxyphenyl)-2-(4-methylanilino)acetamide?
The InChIKey is ZPDSRMWHCXUFAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O2/c1-9-2-5-11(6-3-9)18-14(15(17)20)12-8-10(16)4-7-13(12)19/h2-8,14,18-19H,1H3,(H2,17,20).
What are the key properties of 2-(5-fluoro-2-hydroxyphenyl)-2-(4-methylanilino)acetamide?
2-(5-fluoro-2-hydroxyphenyl)-2-(4-methylanilino)acetamide has a molecular weight of 274.30 g/mol, XLogP of 2.48, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-2-hydroxyphenyl)-2-(4-methylanilino)acetamide is sourced from PubChem (CID 107698125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).