N-[(2,5-difluorophenyl)methyl]-2-hydroxy-3-methoxybenzamide

C15H13F2NO3 — CID 63373922

IUPACN-[(2,5-difluorophenyl)methyl]-2-hydroxy-3-methoxybenzamide
SMILESCOc1cccc(C(=O)NCc2cc(F)ccc2F)c1O
InChIInChI=1S/C15H13F2NO3/c1-21-13-4-2-3-11(14(13)19)15(20)18-8-9-7-10(16)5-6-12(9)17/h2-7,19H,8H2,1H3,(H,18,20)
InChIKeyZGJUTMWRTKXDMV-UHFFFAOYSA-N
MW293.27 g/mol
LogP2.61
Rot. Bonds4

About N-[(2,5-difluorophenyl)methyl]-2-hydroxy-3-methoxybenzamide

N-[(2,5-difluorophenyl)methyl]-2-hydroxy-3-methoxybenzamide (PubChem CID 63373922) has the molecular formula C15H13F2NO3 and a molecular weight of 293.27 g/mol. Its IUPAC name is N-[(2,5-difluorophenyl)methyl]-2-hydroxy-3-methoxybenzamide.

Molecular Properties

Compound NameN-[(2,5-difluorophenyl)methyl]-2-hydroxy-3-methoxybenzamide
PubChem CID63373922
Molecular FormulaC15H13F2NO3
Molecular Weight293.27 g/mol
Exact Mass293.09
IUPAC NameN-[(2,5-difluorophenyl)methyl]-2-hydroxy-3-methoxybenzamide
SMILESCOc1cccc(C(=O)NCc2cc(F)ccc2F)c1O
InChIInChI=1S/C15H13F2NO3/c1-21-13-4-2-3-11(14(13)19)15(20)18-8-9-7-10(16)5-6-12(9)17/h2-7,19H,8H2,1H3,(H,18,20)
InChIKeyZGJUTMWRTKXDMV-UHFFFAOYSA-N
XLogP2.61
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.27
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5-chloro-2-fluorophenyl)methyl]-2,6-dimethoxybenzamide
CID 110784391
N-[(4-chlorophenyl)methyl]-2-hydroxy-3-methoxybenzamide
CID 11748334
N-[(2,5-difluorophenyl)methyl]-5-fluoro-2-hydroxybenzamide
CID 79880980
2-fluoro-N-[(2-hydroxy-3-methoxyphenyl)methyl]-5-propan-2-ylbenzamide
CID 167959226
N-[(2-fluorophenyl)methyl]-2,3-dimethoxybenzamide
CID 17068329
N-[(2,5-difluorophenyl)methyl]-3,5-dimethoxybenzamide
CID 110780940
5-fluoro-2-methoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 31069159
2-(2-aminoethoxy)-N-[(2,5-difluorophenyl)methyl]-4-methoxybenzamide
CID 118769430
N-[(2,5-difluorophenyl)methyl]-2-fluoropyridine-3-carboxamide
CID 107363072
3-bromo-N-[(2,5-difluorophenyl)methyl]-4-methoxybenzamide
CID 63372843
5-chloro-2-fluoro-N-[(2-methoxyphenyl)methyl]benzamide
CID 26586354
methyl 3-[(2,5-difluorophenyl)methylamino]-3-oxopropanoate
CID 115174318

Frequently Asked Questions

What is the IUPAC name of N-[(2,5-difluorophenyl)methyl]-2-hydroxy-3-methoxybenzamide?
The IUPAC name of N-[(2,5-difluorophenyl)methyl]-2-hydroxy-3-methoxybenzamide (CID 63373922) is N-[(2,5-difluorophenyl)methyl]-2-hydroxy-3-methoxybenzamide.
What is the SMILES notation for N-[(2,5-difluorophenyl)methyl]-2-hydroxy-3-methoxybenzamide?
The canonical SMILES for N-[(2,5-difluorophenyl)methyl]-2-hydroxy-3-methoxybenzamide is COc1cccc(C(=O)NCc2cc(F)ccc2F)c1O.
What is the InChIKey of N-[(2,5-difluorophenyl)methyl]-2-hydroxy-3-methoxybenzamide?
The InChIKey is ZGJUTMWRTKXDMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2NO3/c1-21-13-4-2-3-11(14(13)19)15(20)18-8-9-7-10(16)5-6-12(9)17/h2-7,19H,8H2,1H3,(H,18,20).
What are the key properties of N-[(2,5-difluorophenyl)methyl]-2-hydroxy-3-methoxybenzamide?
N-[(2,5-difluorophenyl)methyl]-2-hydroxy-3-methoxybenzamide has a molecular weight of 293.27 g/mol, XLogP of 2.61, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,5-difluorophenyl)methyl]-2-hydroxy-3-methoxybenzamide is sourced from PubChem (CID 63373922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).