N-(2-fluoro-5-methylphenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide

C23H22FNO4 — CID 9455251

IUPACN-(2-fluoro-5-methylphenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide
SMILESCOc1cc(C(=O)Nc2cc(C)ccc2F)cc(OC)c1OCc1ccccc1
InChIInChI=1S/C23H22FNO4/c1-15-9-10-18(24)19(11-15)25-23(26)17-12-20(27-2)22(21(13-17)28-3)29-14-16-7-5-4-6-8-16/h4-13H,14H2,1-3H3,(H,25,26)
InChIKeyYWFHVZRIQSFKOA-UHFFFAOYSA-N
MW395.43 g/mol
LogP4.98
Rot. Bonds7

About N-(2-fluoro-5-methylphenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide

N-(2-fluoro-5-methylphenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide (PubChem CID 9455251) has the molecular formula C23H22FNO4 and a molecular weight of 395.43 g/mol. Its IUPAC name is N-(2-fluoro-5-methylphenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide.

Molecular Properties

Compound NameN-(2-fluoro-5-methylphenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide
PubChem CID9455251
Molecular FormulaC23H22FNO4
Molecular Weight395.43 g/mol
Exact Mass395.15
IUPAC NameN-(2-fluoro-5-methylphenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide
SMILESCOc1cc(C(=O)Nc2cc(C)ccc2F)cc(OC)c1OCc1ccccc1
InChIInChI=1S/C23H22FNO4/c1-15-9-10-18(24)19(11-15)25-23(26)17-12-20(27-2)22(21(13-17)28-3)29-14-16-7-5-4-6-8-16/h4-13H,14H2,1-3H3,(H,25,26)
InChIKeyYWFHVZRIQSFKOA-UHFFFAOYSA-N
XLogP4.98
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.43
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-carbamoyl-2,4-difluorophenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide
CID 56570661
N-(4-chlorophenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide
CID 9243640
methyl 3-[(3,5-dimethoxy-4-phenylmethoxybenzoyl)amino]-4-methylbenzoate
CID 16567479
3,5-dimethoxy-4-phenylmethoxy-N-(4-phenylmethoxyphenyl)benzamide
CID 139779676
4-(2-amino-2-oxoethoxy)-3-chloro-N-(2-fluoro-5-methylphenyl)-5-methoxybenzamide
CID 42475729
N-(3-chlorophenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide
CID 9243538
N-(4-bromophenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide
CID 16567430
N-(2-aminoethyl)-3,5-dimethoxy-4-phenylmethoxybenzamide
CID 119384512
3,5-dimethoxy-4-phenylmethoxy-N-(2-pyrrolidin-1-ylphenyl)benzamide
CID 46526102
3,5-dimethoxy-N-[2-(4-methylphenoxy)ethyl]-4-phenylmethoxybenzamide
CID 9456714
N-(3-methylphenyl)-3,4,5-tris(phenylmethoxy)benzamide
CID 122498346
3,5-dimethoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-4-phenylmethoxybenzamide
CID 55700663

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-5-methylphenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide?
The IUPAC name of N-(2-fluoro-5-methylphenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide (CID 9455251) is N-(2-fluoro-5-methylphenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide.
What is the SMILES notation for N-(2-fluoro-5-methylphenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide?
The canonical SMILES for N-(2-fluoro-5-methylphenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide is COc1cc(C(=O)Nc2cc(C)ccc2F)cc(OC)c1OCc1ccccc1.
What is the InChIKey of N-(2-fluoro-5-methylphenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide?
The InChIKey is YWFHVZRIQSFKOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22FNO4/c1-15-9-10-18(24)19(11-15)25-23(26)17-12-20(27-2)22(21(13-17)28-3)29-14-16-7-5-4-6-8-16/h4-13H,14H2,1-3H3,(H,25,26).
What are the key properties of N-(2-fluoro-5-methylphenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide?
N-(2-fluoro-5-methylphenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide has a molecular weight of 395.43 g/mol, XLogP of 4.98, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-methylphenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide is sourced from PubChem (CID 9455251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).