3-[(4-fluorophenyl)methoxy]-5-hydroxy-N-methylbenzamide

C15H14FNO3 — CID 144990998

IUPAC3-[(4-fluorophenyl)methoxy]-5-hydroxy-N-methylbenzamide
SMILESCNC(=O)c1cc(O)cc(OCc2ccc(F)cc2)c1
InChIInChI=1S/C15H14FNO3/c1-17-15(19)11-6-13(18)8-14(7-11)20-9-10-2-4-12(16)5-3-10/h2-8,18H,9H2,1H3,(H,17,19)
InChIKeyNDIADJXUAOXEIC-UHFFFAOYSA-N
MW275.28 g/mol
LogP2.47
Rot. Bonds4

About 3-[(4-fluorophenyl)methoxy]-5-hydroxy-N-methylbenzamide

3-[(4-fluorophenyl)methoxy]-5-hydroxy-N-methylbenzamide (PubChem CID 144990998) has the molecular formula C15H14FNO3 and a molecular weight of 275.28 g/mol. Its IUPAC name is 3-[(4-fluorophenyl)methoxy]-5-hydroxy-N-methylbenzamide.

Molecular Properties

Compound Name3-[(4-fluorophenyl)methoxy]-5-hydroxy-N-methylbenzamide
PubChem CID144990998
Molecular FormulaC15H14FNO3
Molecular Weight275.28 g/mol
Exact Mass275.10
IUPAC Name3-[(4-fluorophenyl)methoxy]-5-hydroxy-N-methylbenzamide
SMILESCNC(=O)c1cc(O)cc(OCc2ccc(F)cc2)c1
InChIInChI=1S/C15H14FNO3/c1-17-15(19)11-6-13(18)8-14(7-11)20-9-10-2-4-12(16)5-3-10/h2-8,18H,9H2,1H3,(H,17,19)
InChIKeyNDIADJXUAOXEIC-UHFFFAOYSA-N
XLogP2.47
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.28
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-fluoro-5-[(4-fluorophenyl)methoxy]phenol
CID 146557101
3-amino-4-[(4-fluorophenyl)methoxy]-N-methylbenzamide
CID 82070222
3-[(4-fluorophenyl)methoxy]-N-(3-methylbutan-2-yl)benzamide
CID 43035024
N-methyl-4-phenylmethoxybenzamide
CID 2996745
2-[(4-fluorophenyl)methoxy]-N-[3-(methylcarbamoyl)phenyl]benzamide
CID 16550314
3-[(4-fluorophenyl)methoxy]benzamide
CID 18354605
N-methyl-5-phenylmethoxypyridine-3-carboxamide
CID 123214761
(3-hydroxy-5-phenylmethoxyphenyl)-phenylmethanone
CID 71119902
2-[4-[(4-fluorophenyl)methoxy]phenyl]-2-oxoacetaldehyde
CID 13340101
1-fluoro-3-[(4-fluorophenyl)methoxy]-5-methylbenzene
CID 143178239
5-[(4-fluorophenyl)methoxy]-N,1-dimethyl-4-oxopyridine-2-carboxamide
CID 42441092
2-hydroxy-4-[(4-methoxyphenyl)methoxy]-N-methylbenzamide
CID 68959972

Frequently Asked Questions

What is the IUPAC name of 3-[(4-fluorophenyl)methoxy]-5-hydroxy-N-methylbenzamide?
The IUPAC name of 3-[(4-fluorophenyl)methoxy]-5-hydroxy-N-methylbenzamide (CID 144990998) is 3-[(4-fluorophenyl)methoxy]-5-hydroxy-N-methylbenzamide.
What is the SMILES notation for 3-[(4-fluorophenyl)methoxy]-5-hydroxy-N-methylbenzamide?
The canonical SMILES for 3-[(4-fluorophenyl)methoxy]-5-hydroxy-N-methylbenzamide is CNC(=O)c1cc(O)cc(OCc2ccc(F)cc2)c1.
What is the InChIKey of 3-[(4-fluorophenyl)methoxy]-5-hydroxy-N-methylbenzamide?
The InChIKey is NDIADJXUAOXEIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNO3/c1-17-15(19)11-6-13(18)8-14(7-11)20-9-10-2-4-12(16)5-3-10/h2-8,18H,9H2,1H3,(H,17,19).
What are the key properties of 3-[(4-fluorophenyl)methoxy]-5-hydroxy-N-methylbenzamide?
3-[(4-fluorophenyl)methoxy]-5-hydroxy-N-methylbenzamide has a molecular weight of 275.28 g/mol, XLogP of 2.47, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-fluorophenyl)methoxy]-5-hydroxy-N-methylbenzamide is sourced from PubChem (CID 144990998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).