N-(2-fluoro-5-methylphenyl)-4-(pyridin-3-ylmethoxy)benzamide

C20H17FN2O2 — CID 39676400

IUPACN-(2-fluoro-5-methylphenyl)-4-(pyridin-3-ylmethoxy)benzamide
SMILESCc1ccc(F)c(NC(=O)c2ccc(OCc3cccnc3)cc2)c1
InChIInChI=1S/C20H17FN2O2/c1-14-4-9-18(21)19(11-14)23-20(24)16-5-7-17(8-6-16)25-13-15-3-2-10-22-12-15/h2-12H,13H2,1H3,(H,23,24)
InChIKeyDSYFAYBERJMEML-UHFFFAOYSA-N
MW336.37 g/mol
LogP4.36
Rot. Bonds5

About N-(2-fluoro-5-methylphenyl)-4-(pyridin-3-ylmethoxy)benzamide

N-(2-fluoro-5-methylphenyl)-4-(pyridin-3-ylmethoxy)benzamide (PubChem CID 39676400) has the molecular formula C20H17FN2O2 and a molecular weight of 336.37 g/mol. Its IUPAC name is N-(2-fluoro-5-methylphenyl)-4-(pyridin-3-ylmethoxy)benzamide.

Molecular Properties

Compound NameN-(2-fluoro-5-methylphenyl)-4-(pyridin-3-ylmethoxy)benzamide
PubChem CID39676400
Molecular FormulaC20H17FN2O2
Molecular Weight336.37 g/mol
Exact Mass336.13
IUPAC NameN-(2-fluoro-5-methylphenyl)-4-(pyridin-3-ylmethoxy)benzamide
SMILESCc1ccc(F)c(NC(=O)c2ccc(OCc3cccnc3)cc2)c1
InChIInChI=1S/C20H17FN2O2/c1-14-4-9-18(21)19(11-14)23-20(24)16-5-7-17(8-6-16)25-13-15-3-2-10-22-12-15/h2-12H,13H2,1H3,(H,23,24)
InChIKeyDSYFAYBERJMEML-UHFFFAOYSA-N
XLogP4.36
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.37
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-fluoro-3-methylphenyl)methyl]-4-(pyridin-3-ylmethoxy)benzamide
CID 39697713
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(2-fluoro-5-methylphenyl)benzamide
CID 34233334
N-(2-methoxy-5-methylphenyl)-2-[4-(pyridin-3-ylmethoxy)phenoxy]acetamide
CID 60525115
N-(2-fluoro-5-methylphenyl)-4-methylbenzamide
CID 7718843
5-[(4-acetylphenoxy)methyl]-N-(2-fluoro-5-methylphenyl)furan-2-carboxamide
CID 19455249
N-(2-fluoro-5-methylphenyl)-4-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 40722968
pyridin-3-ylmethyl N-[[4-[(2-amino-4-methylphenyl)carbamoyl]phenyl]methyl]carbamate
CID 10572471
4-methylsulfanyl-N-[3-(pyridin-3-ylmethoxy)phenyl]benzamide
CID 78890950
N-(2-anilino-2-oxoethyl)-4-(pyridin-3-ylmethoxy)benzamide
CID 166190877
N-(2-fluoro-5-methylphenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide
CID 9455251
N-[(3,5-dimethoxyphenyl)methyl]-4-(pyridin-3-ylmethoxy)benzamide
CID 46590121
4-(chloromethyl)-N-(2-fluoro-5-methylphenyl)benzamide
CID 43333534

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-5-methylphenyl)-4-(pyridin-3-ylmethoxy)benzamide?
The IUPAC name of N-(2-fluoro-5-methylphenyl)-4-(pyridin-3-ylmethoxy)benzamide (CID 39676400) is N-(2-fluoro-5-methylphenyl)-4-(pyridin-3-ylmethoxy)benzamide.
What is the SMILES notation for N-(2-fluoro-5-methylphenyl)-4-(pyridin-3-ylmethoxy)benzamide?
The canonical SMILES for N-(2-fluoro-5-methylphenyl)-4-(pyridin-3-ylmethoxy)benzamide is Cc1ccc(F)c(NC(=O)c2ccc(OCc3cccnc3)cc2)c1.
What is the InChIKey of N-(2-fluoro-5-methylphenyl)-4-(pyridin-3-ylmethoxy)benzamide?
The InChIKey is DSYFAYBERJMEML-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17FN2O2/c1-14-4-9-18(21)19(11-14)23-20(24)16-5-7-17(8-6-16)25-13-15-3-2-10-22-12-15/h2-12H,13H2,1H3,(H,23,24).
What are the key properties of N-(2-fluoro-5-methylphenyl)-4-(pyridin-3-ylmethoxy)benzamide?
N-(2-fluoro-5-methylphenyl)-4-(pyridin-3-ylmethoxy)benzamide has a molecular weight of 336.37 g/mol, XLogP of 4.36, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-methylphenyl)-4-(pyridin-3-ylmethoxy)benzamide is sourced from PubChem (CID 39676400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).