N-(2-amino-4-methylphenyl)-2-fluoro-4-methoxybenzamide

C15H15FN2O2 — CID 102881866

IUPACN-(2-amino-4-methylphenyl)-2-fluoro-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(C)cc2N)c(F)c1
InChIInChI=1S/C15H15FN2O2/c1-9-3-6-14(13(17)7-9)18-15(19)11-5-4-10(20-2)8-12(11)16/h3-8H,17H2,1-2H3,(H,18,19)
InChIKeyVHEQDRNOLGPRLQ-UHFFFAOYSA-N
MW274.30 g/mol
LogP2.98
Rot. Bonds3

About N-(2-amino-4-methylphenyl)-2-fluoro-4-methoxybenzamide

N-(2-amino-4-methylphenyl)-2-fluoro-4-methoxybenzamide (PubChem CID 102881866) has the molecular formula C15H15FN2O2 and a molecular weight of 274.30 g/mol. Its IUPAC name is N-(2-amino-4-methylphenyl)-2-fluoro-4-methoxybenzamide.

Molecular Properties

Compound NameN-(2-amino-4-methylphenyl)-2-fluoro-4-methoxybenzamide
PubChem CID102881866
Molecular FormulaC15H15FN2O2
Molecular Weight274.30 g/mol
Exact Mass274.11
IUPAC NameN-(2-amino-4-methylphenyl)-2-fluoro-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(C)cc2N)c(F)c1
InChIInChI=1S/C15H15FN2O2/c1-9-3-6-14(13(17)7-9)18-15(19)11-5-4-10(20-2)8-12(11)16/h3-8H,17H2,1-2H3,(H,18,19)
InChIKeyVHEQDRNOLGPRLQ-UHFFFAOYSA-N
XLogP2.98
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-amino-4-hydroxyphenyl)-2-fluoro-4-methoxybenzamide
CID 107697209
N-(2-amino-4-methylphenyl)-2-hydroxy-4-methoxybenzamide
CID 43259027
ethyl N-[3-[(2-fluoro-4-methoxybenzoyl)amino]-2-methylphenyl]carbamate
CID 87043158
2-fluoro-N-(4-fluoro-2-iodophenyl)-4-methoxybenzamide
CID 103737180
2-fluoro-4-methoxy-N-(6-methoxy-2-methyl-3-pyridinyl)benzamide
CID 71970253
2-amino-N-(2-hydroxy-4-methoxyphenyl)-5-methylbenzamide
CID 102695337
N-(2-amino-4-methoxyphenyl)-5-chloro-2-methoxybenzamide
CID 29274206
N-(2-fluoro-5-methylphenyl)-2,4-dimethoxybenzamide
CID 16546475
2-amino-N-(2-hydroxy-5-methylphenyl)-4-methoxybenzamide
CID 80504227
2-fluoro-N,4-dimethoxybenzamide
CID 103606176
N-(3-amino-4-methoxyphenyl)-2-fluoro-4-methoxybenzamide
CID 103805146
N-(2-amino-4-methylphenyl)-2-chloro-4-fluorobenzamide
CID 43259104

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-methylphenyl)-2-fluoro-4-methoxybenzamide?
The IUPAC name of N-(2-amino-4-methylphenyl)-2-fluoro-4-methoxybenzamide (CID 102881866) is N-(2-amino-4-methylphenyl)-2-fluoro-4-methoxybenzamide.
What is the SMILES notation for N-(2-amino-4-methylphenyl)-2-fluoro-4-methoxybenzamide?
The canonical SMILES for N-(2-amino-4-methylphenyl)-2-fluoro-4-methoxybenzamide is COc1ccc(C(=O)Nc2ccc(C)cc2N)c(F)c1.
What is the InChIKey of N-(2-amino-4-methylphenyl)-2-fluoro-4-methoxybenzamide?
The InChIKey is VHEQDRNOLGPRLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O2/c1-9-3-6-14(13(17)7-9)18-15(19)11-5-4-10(20-2)8-12(11)16/h3-8H,17H2,1-2H3,(H,18,19).
What are the key properties of N-(2-amino-4-methylphenyl)-2-fluoro-4-methoxybenzamide?
N-(2-amino-4-methylphenyl)-2-fluoro-4-methoxybenzamide has a molecular weight of 274.30 g/mol, XLogP of 2.98, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-methylphenyl)-2-fluoro-4-methoxybenzamide is sourced from PubChem (CID 102881866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).