3-N-(5-fluoro-2-hydroxyphenyl)-1-N-methylbenzene-1,3-dicarboxamide

C15H13FN2O3 — CID 71863070

IUPAC3-N-(5-fluoro-2-hydroxyphenyl)-1-N-methylbenzene-1,3-dicarboxamide
SMILESCNC(=O)c1cccc(C(=O)Nc2cc(F)ccc2O)c1
InChIInChI=1S/C15H13FN2O3/c1-17-14(20)9-3-2-4-10(7-9)15(21)18-12-8-11(16)5-6-13(12)19/h2-8,19H,1H3,(H,17,20)(H,18,21)
InChIKeyUUXXRRRIBPMBJT-UHFFFAOYSA-N
MW288.28 g/mol
LogP2.14
Rot. Bonds3

About 3-N-(5-fluoro-2-hydroxyphenyl)-1-N-methylbenzene-1,3-dicarboxamide

3-N-(5-fluoro-2-hydroxyphenyl)-1-N-methylbenzene-1,3-dicarboxamide (PubChem CID 71863070) has the molecular formula C15H13FN2O3 and a molecular weight of 288.28 g/mol. Its IUPAC name is 3-N-(5-fluoro-2-hydroxyphenyl)-1-N-methylbenzene-1,3-dicarboxamide.

Molecular Properties

Compound Name3-N-(5-fluoro-2-hydroxyphenyl)-1-N-methylbenzene-1,3-dicarboxamide
PubChem CID71863070
Molecular FormulaC15H13FN2O3
Molecular Weight288.28 g/mol
Exact Mass288.09
IUPAC Name3-N-(5-fluoro-2-hydroxyphenyl)-1-N-methylbenzene-1,3-dicarboxamide
SMILESCNC(=O)c1cccc(C(=O)Nc2cc(F)ccc2O)c1
InChIInChI=1S/C15H13FN2O3/c1-17-14(20)9-3-2-4-10(7-9)15(21)18-12-8-11(16)5-6-13(12)19/h2-8,19H,1H3,(H,17,20)(H,18,21)
InChIKeyUUXXRRRIBPMBJT-UHFFFAOYSA-N
XLogP2.14
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.28
LogP ≤ 52.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-N-(5-fluoro-2-hydroxyphenyl)-1-N-methylbenzene-1,3-dicarboxamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(5-fluoro-2-hydroxyphenyl)-3-nitrobenzamide
CID 90714767
3-fluoro-N-(2-hydroxyphenyl)benzamide
CID 45029698
3-[(2-hydroxy-5-methylphenyl)carbamoyl]benzoic acid
CID 75465271
N-(5-fluoro-2-methylphenyl)-3-methylbenzamide
CID 4522552
N-[4-fluoro-2-(methylamino)phenyl]benzamide
CID 174747297
3-[(4-fluoro-2-methylphenyl)carbamoyl]benzoic acid
CID 43452888
3-fluoro-N-(2-hydroxy-4-methylphenyl)benzamide
CID 2112106
3-fluoro-N-[(2-hydroxy-5-propan-2-ylphenyl)carbamothioyl]benzamide
CID 17099495
1-N,3-N-bis[5-[2-(3-acetamido-4-hydroxyphenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-hydroxyphenyl]benzene-1,3-dicarboxamide
CID 58868378
N-(2-acetamidophenyl)-3-fluorobenzamide
CID 877390
N-(2-chloro-5-fluorophenyl)-3,4-dihydroxybenzamide
CID 103956903
N-[2-hydroxy-5-[4-hydroxy-3-[(3-methylbenzoyl)amino]benzoyl]phenyl]-3-methylbenzamide
CID 139492461

Frequently Asked Questions

What is the IUPAC name of 3-N-(5-fluoro-2-hydroxyphenyl)-1-N-methylbenzene-1,3-dicarboxamide?
The IUPAC name of 3-N-(5-fluoro-2-hydroxyphenyl)-1-N-methylbenzene-1,3-dicarboxamide (CID 71863070) is 3-N-(5-fluoro-2-hydroxyphenyl)-1-N-methylbenzene-1,3-dicarboxamide.
What is the SMILES notation for 3-N-(5-fluoro-2-hydroxyphenyl)-1-N-methylbenzene-1,3-dicarboxamide?
The canonical SMILES for 3-N-(5-fluoro-2-hydroxyphenyl)-1-N-methylbenzene-1,3-dicarboxamide is CNC(=O)c1cccc(C(=O)Nc2cc(F)ccc2O)c1.
What is the InChIKey of 3-N-(5-fluoro-2-hydroxyphenyl)-1-N-methylbenzene-1,3-dicarboxamide?
The InChIKey is UUXXRRRIBPMBJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN2O3/c1-17-14(20)9-3-2-4-10(7-9)15(21)18-12-8-11(16)5-6-13(12)19/h2-8,19H,1H3,(H,17,20)(H,18,21).
What are the key properties of 3-N-(5-fluoro-2-hydroxyphenyl)-1-N-methylbenzene-1,3-dicarboxamide?
3-N-(5-fluoro-2-hydroxyphenyl)-1-N-methylbenzene-1,3-dicarboxamide has a molecular weight of 288.28 g/mol, XLogP of 2.14, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(5-fluoro-2-hydroxyphenyl)-1-N-methylbenzene-1,3-dicarboxamide is sourced from PubChem (CID 71863070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).