3-[2-(4-fluorophenoxy)pyrimidin-5-yl]-N-(2-methoxyphenyl)benzamide

C24H18FN3O3 — CID 53116926

IUPAC3-[2-(4-fluorophenoxy)pyrimidin-5-yl]-N-(2-methoxyphenyl)benzamide
SMILESCOc1ccccc1NC(=O)c1cccc(-c2cnc(Oc3ccc(F)cc3)nc2)c1
InChIInChI=1S/C24H18FN3O3/c1-30-22-8-3-2-7-21(22)28-23(29)17-6-4-5-16(13-17)18-14-26-24(27-15-18)31-20-11-9-19(25)10-12-20/h2-15H,1H3,(H,28,29)
InChIKeyODVMZQXUHUNWPG-UHFFFAOYSA-N
MW415.42 g/mol
LogP5.34
Rot. Bonds6

About 3-[2-(4-fluorophenoxy)pyrimidin-5-yl]-N-(2-methoxyphenyl)benzamide

3-[2-(4-fluorophenoxy)pyrimidin-5-yl]-N-(2-methoxyphenyl)benzamide (PubChem CID 53116926) has the molecular formula C24H18FN3O3 and a molecular weight of 415.42 g/mol. Its IUPAC name is 3-[2-(4-fluorophenoxy)pyrimidin-5-yl]-N-(2-methoxyphenyl)benzamide.

Molecular Properties

Compound Name3-[2-(4-fluorophenoxy)pyrimidin-5-yl]-N-(2-methoxyphenyl)benzamide
PubChem CID53116926
Molecular FormulaC24H18FN3O3
Molecular Weight415.42 g/mol
Exact Mass415.13
IUPAC Name3-[2-(4-fluorophenoxy)pyrimidin-5-yl]-N-(2-methoxyphenyl)benzamide
SMILESCOc1ccccc1NC(=O)c1cccc(-c2cnc(Oc3ccc(F)cc3)nc2)c1
InChIInChI=1S/C24H18FN3O3/c1-30-22-8-3-2-7-21(22)28-23(29)17-6-4-5-16(13-17)18-14-26-24(27-15-18)31-20-11-9-19(25)10-12-20/h2-15H,1H3,(H,28,29)
InChIKeyODVMZQXUHUNWPG-UHFFFAOYSA-N
XLogP5.34
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500415.42
LogP ≤ 55.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-[2-(4-fluorophenoxy)pyrimidin-5-yl]-N-(2-methoxyphenyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-chloro-4-methoxyphenyl)-3-[2-(4-fluorophenoxy)pyrimidin-5-yl]benzamide
CID 53116939
3-[2-(4-methoxyphenoxy)pyrimidin-5-yl]-N-(2-methylphenyl)benzamide
CID 53002812
N-[(4-fluorophenyl)methyl]-3-[2-(4-methoxyphenoxy)pyrimidin-5-yl]benzamide
CID 53116852
N-(3-chloro-4-fluorophenyl)-3-(2-phenoxypyrimidin-5-yl)benzamide
CID 53116991
3-methoxy-N-(2-phenoxypyrimidin-5-yl)benzamide
CID 122302206
N-(3-bromophenyl)-3-(2-phenoxypyrimidin-5-yl)benzamide
CID 53116986
N-(4-bromophenyl)-3-[2-(3-methoxyphenoxy)pyrimidin-5-yl]benzamide
CID 53116889
N-[(2,4-dimethoxyphenyl)methyl]-3-[2-(3-methoxyphenoxy)pyrimidin-5-yl]benzamide
CID 53116904
N-(3-methoxypropyl)-3-(2-phenoxypyrimidin-5-yl)benzamide
CID 53116963
N-(2-methoxyphenyl)-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide
CID 50828728
4-[(4-fluorobenzoyl)amino]-N-(2-methoxyphenyl)benzamide
CID 2677066
N-[2-(2-fluorophenoxy)pyrimidin-5-yl]-3,4-dimethoxybenzamide
CID 91968353

Frequently Asked Questions

What is the IUPAC name of 3-[2-(4-fluorophenoxy)pyrimidin-5-yl]-N-(2-methoxyphenyl)benzamide?
The IUPAC name of 3-[2-(4-fluorophenoxy)pyrimidin-5-yl]-N-(2-methoxyphenyl)benzamide (CID 53116926) is 3-[2-(4-fluorophenoxy)pyrimidin-5-yl]-N-(2-methoxyphenyl)benzamide.
What is the SMILES notation for 3-[2-(4-fluorophenoxy)pyrimidin-5-yl]-N-(2-methoxyphenyl)benzamide?
The canonical SMILES for 3-[2-(4-fluorophenoxy)pyrimidin-5-yl]-N-(2-methoxyphenyl)benzamide is COc1ccccc1NC(=O)c1cccc(-c2cnc(Oc3ccc(F)cc3)nc2)c1.
What is the InChIKey of 3-[2-(4-fluorophenoxy)pyrimidin-5-yl]-N-(2-methoxyphenyl)benzamide?
The InChIKey is ODVMZQXUHUNWPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18FN3O3/c1-30-22-8-3-2-7-21(22)28-23(29)17-6-4-5-16(13-17)18-14-26-24(27-15-18)31-20-11-9-19(25)10-12-20/h2-15H,1H3,(H,28,29).
What are the key properties of 3-[2-(4-fluorophenoxy)pyrimidin-5-yl]-N-(2-methoxyphenyl)benzamide?
3-[2-(4-fluorophenoxy)pyrimidin-5-yl]-N-(2-methoxyphenyl)benzamide has a molecular weight of 415.42 g/mol, XLogP of 5.34, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(4-fluorophenoxy)pyrimidin-5-yl]-N-(2-methoxyphenyl)benzamide is sourced from PubChem (CID 53116926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).