3-fluoro-N-[(2-methoxyphenyl)methyl]-2-(methylamino)benzamide

C16H17FN2O2 — CID 62648542

IUPAC3-fluoro-N-[(2-methoxyphenyl)methyl]-2-(methylamino)benzamide
SMILESCNc1c(F)cccc1C(=O)NCc1ccccc1OC
InChIInChI=1S/C16H17FN2O2/c1-18-15-12(7-5-8-13(15)17)16(20)19-10-11-6-3-4-9-14(11)21-2/h3-9,18H,10H2,1-2H3,(H,19,20)
InChIKeyQEYBCJIDUVQPMW-UHFFFAOYSA-N
MW288.32 g/mol
LogP2.81
Rot. Bonds5

About 3-fluoro-N-[(2-methoxyphenyl)methyl]-2-(methylamino)benzamide

3-fluoro-N-[(2-methoxyphenyl)methyl]-2-(methylamino)benzamide (PubChem CID 62648542) has the molecular formula C16H17FN2O2 and a molecular weight of 288.32 g/mol. Its IUPAC name is 3-fluoro-N-[(2-methoxyphenyl)methyl]-2-(methylamino)benzamide.

Molecular Properties

Compound Name3-fluoro-N-[(2-methoxyphenyl)methyl]-2-(methylamino)benzamide
PubChem CID62648542
Molecular FormulaC16H17FN2O2
Molecular Weight288.32 g/mol
Exact Mass288.13
IUPAC Name3-fluoro-N-[(2-methoxyphenyl)methyl]-2-(methylamino)benzamide
SMILESCNc1c(F)cccc1C(=O)NCc1ccccc1OC
InChIInChI=1S/C16H17FN2O2/c1-18-15-12(7-5-8-13(15)17)16(20)19-10-11-6-3-4-9-14(11)21-2/h3-9,18H,10H2,1-2H3,(H,19,20)
InChIKeyQEYBCJIDUVQPMW-UHFFFAOYSA-N
XLogP2.81
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.32
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-ethylphenyl)methyl]-3-fluoro-2-(methylamino)benzamide
CID 64693951
N-[(2-fluorophenyl)methyl]-2,3-dimethoxybenzamide
CID 17068329
2,3-dimethoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 912335
N-benzyl-3-fluoro-2-(methylamino)benzamide
CID 55100092
3-fluoro-2-[(2-methoxyphenyl)methylamino]benzoic acid
CID 62648491
5-chloro-2-fluoro-N-[(2-methoxyphenyl)methyl]benzamide
CID 26586354
3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide
CID 82786350
5-fluoro-2-methoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 31069159
2-iodo-N-[(2-methoxyphenyl)methyl]benzamide
CID 1378811
2-(difluoromethoxy)-3-methoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 51143674
[2-[(2-methoxyphenyl)methylcarbamoyl]phenyl] acetate
CID 3362065
2,4,5-trimethoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 912738

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[(2-methoxyphenyl)methyl]-2-(methylamino)benzamide?
The IUPAC name of 3-fluoro-N-[(2-methoxyphenyl)methyl]-2-(methylamino)benzamide (CID 62648542) is 3-fluoro-N-[(2-methoxyphenyl)methyl]-2-(methylamino)benzamide.
What is the SMILES notation for 3-fluoro-N-[(2-methoxyphenyl)methyl]-2-(methylamino)benzamide?
The canonical SMILES for 3-fluoro-N-[(2-methoxyphenyl)methyl]-2-(methylamino)benzamide is CNc1c(F)cccc1C(=O)NCc1ccccc1OC.
What is the InChIKey of 3-fluoro-N-[(2-methoxyphenyl)methyl]-2-(methylamino)benzamide?
The InChIKey is QEYBCJIDUVQPMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O2/c1-18-15-12(7-5-8-13(15)17)16(20)19-10-11-6-3-4-9-14(11)21-2/h3-9,18H,10H2,1-2H3,(H,19,20).
What are the key properties of 3-fluoro-N-[(2-methoxyphenyl)methyl]-2-(methylamino)benzamide?
3-fluoro-N-[(2-methoxyphenyl)methyl]-2-(methylamino)benzamide has a molecular weight of 288.32 g/mol, XLogP of 2.81, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[(2-methoxyphenyl)methyl]-2-(methylamino)benzamide is sourced from PubChem (CID 62648542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).