4-[(5-fluoro-2-methoxyphenyl)methylamino]-N-hydroxybenzamide

C15H15FN2O3 — CID 134492118

IUPAC4-[(5-fluoro-2-methoxyphenyl)methylamino]-N-hydroxybenzamide
SMILESCOc1ccc(F)cc1CNc1ccc(C(=O)NO)cc1
InChIInChI=1S/C15H15FN2O3/c1-21-14-7-4-12(16)8-11(14)9-17-13-5-2-10(3-6-13)15(19)18-20/h2-8,17,20H,9H2,1H3,(H,18,19)
InChIKeyJWQKGJSFFPCFSU-UHFFFAOYSA-N
MW290.29 g/mol
LogP2.57
Rot. Bonds5

About 4-[(5-fluoro-2-methoxyphenyl)methylamino]-N-hydroxybenzamide

4-[(5-fluoro-2-methoxyphenyl)methylamino]-N-hydroxybenzamide (PubChem CID 134492118) has the molecular formula C15H15FN2O3 and a molecular weight of 290.29 g/mol. Its IUPAC name is 4-[(5-fluoro-2-methoxyphenyl)methylamino]-N-hydroxybenzamide.

Molecular Properties

Compound Name4-[(5-fluoro-2-methoxyphenyl)methylamino]-N-hydroxybenzamide
PubChem CID134492118
Molecular FormulaC15H15FN2O3
Molecular Weight290.29 g/mol
Exact Mass290.11
IUPAC Name4-[(5-fluoro-2-methoxyphenyl)methylamino]-N-hydroxybenzamide
SMILESCOc1ccc(F)cc1CNc1ccc(C(=O)NO)cc1
InChIInChI=1S/C15H15FN2O3/c1-21-14-7-4-12(16)8-11(14)9-17-13-5-2-10(3-6-13)15(19)18-20/h2-8,17,20H,9H2,1H3,(H,18,19)
InChIKeyJWQKGJSFFPCFSU-UHFFFAOYSA-N
XLogP2.57
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.29
LogP ≤ 52.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-fluoro-N-[(5-fluoro-2-methoxyphenyl)methyl]aniline
CID 82131275
4-[(5-chloro-2-methoxyphenyl)methylamino]-N-methylbenzamide
CID 60696773
4-fluoro-N-[(2-methoxy-5-methylphenyl)methyl]aniline
CID 43408473
N-[(5-acetamido-2-methoxyphenyl)methyl]-4-fluorobenzamide
CID 110784125
methyl 4-[(2,5-difluorophenyl)methylamino]benzoate
CID 43312807
4-[(2-methoxy-5-methylphenyl)methylamino]benzamide
CID 43408573
4-[(2-bromo-4-fluorophenyl)methylamino]-N-ethylbenzamide
CID 107095670
N-[(5-fluoro-2-methoxyphenyl)methyl]-2-(2-methoxyphenyl)acetamide
CID 110780208
N-[(5-fluoro-2-methoxyphenyl)methyl]-3,5-dimethoxybenzamide
CID 110780162
methyl 3-bromo-4-[(4-fluoroanilino)methyl]benzoate
CID 102766440
1-N-(3,4-dimethoxyphenyl)-4-N-hydroxybenzene-1,4-dicarboxamide
CID 126493303
4-[(2-chloro-4-fluorophenyl)methylamino]-N-methylbenzamide
CID 103605319

Frequently Asked Questions

What is the IUPAC name of 4-[(5-fluoro-2-methoxyphenyl)methylamino]-N-hydroxybenzamide?
The IUPAC name of 4-[(5-fluoro-2-methoxyphenyl)methylamino]-N-hydroxybenzamide (CID 134492118) is 4-[(5-fluoro-2-methoxyphenyl)methylamino]-N-hydroxybenzamide.
What is the SMILES notation for 4-[(5-fluoro-2-methoxyphenyl)methylamino]-N-hydroxybenzamide?
The canonical SMILES for 4-[(5-fluoro-2-methoxyphenyl)methylamino]-N-hydroxybenzamide is COc1ccc(F)cc1CNc1ccc(C(=O)NO)cc1.
What is the InChIKey of 4-[(5-fluoro-2-methoxyphenyl)methylamino]-N-hydroxybenzamide?
The InChIKey is JWQKGJSFFPCFSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O3/c1-21-14-7-4-12(16)8-11(14)9-17-13-5-2-10(3-6-13)15(19)18-20/h2-8,17,20H,9H2,1H3,(H,18,19).
What are the key properties of 4-[(5-fluoro-2-methoxyphenyl)methylamino]-N-hydroxybenzamide?
4-[(5-fluoro-2-methoxyphenyl)methylamino]-N-hydroxybenzamide has a molecular weight of 290.29 g/mol, XLogP of 2.57, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5-fluoro-2-methoxyphenyl)methylamino]-N-hydroxybenzamide is sourced from PubChem (CID 134492118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).