2-(4-fluorobenzoyl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide

C23H20FN3O3 — CID 46553100

IUPAC2-(4-fluorobenzoyl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide
SMILESO=C(Nc1ccc(N2CCOCC2)nc1)c1ccccc1C(=O)c1ccc(F)cc1
InChIInChI=1S/C23H20FN3O3/c24-17-7-5-16(6-8-17)22(28)19-3-1-2-4-20(19)23(29)26-18-9-10-21(25-15-18)27-11-13-30-14-12-27/h1-10,15H,11-14H2,(H,26,29)
InChIKeyZIKIIASPQPEZQW-UHFFFAOYSA-N
MW405.43 g/mol
LogP3.54
Rot. Bonds5

About 2-(4-fluorobenzoyl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide

2-(4-fluorobenzoyl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide (PubChem CID 46553100) has the molecular formula C23H20FN3O3 and a molecular weight of 405.43 g/mol. Its IUPAC name is 2-(4-fluorobenzoyl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide.

Molecular Properties

Compound Name2-(4-fluorobenzoyl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide
PubChem CID46553100
Molecular FormulaC23H20FN3O3
Molecular Weight405.43 g/mol
Exact Mass405.15
IUPAC Name2-(4-fluorobenzoyl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide
SMILESO=C(Nc1ccc(N2CCOCC2)nc1)c1ccccc1C(=O)c1ccc(F)cc1
InChIInChI=1S/C23H20FN3O3/c24-17-7-5-16(6-8-17)22(28)19-3-1-2-4-20(19)23(29)26-18-9-10-21(25-15-18)27-11-13-30-14-12-27/h1-10,15H,11-14H2,(H,26,29)
InChIKeyZIKIIASPQPEZQW-UHFFFAOYSA-N
XLogP3.54
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.43
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide
CID 119946355
N-(6-morpholin-4-yl-3-pyridinyl)naphthalene-2-carboxamide
CID 3975213
N'-(4-fluorobenzoyl)-6-morpholin-4-ylpyridine-3-carbohydrazide
CID 46697479
N-[6-(azepan-1-yl)-3-pyridinyl]-4-fluorobenzamide
CID 113015884
1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea
CID 47162241
2-methyl-N-(6-morpholin-4-yl-3-pyridinyl)quinoline-3-carboxamide
CID 86915804
2,5-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)thiophene-3-carboxamide
CID 18158652
2-fluoro-N-[6-[4-(2-fluorophenyl)piperazin-1-yl]-3-pyridinyl]benzamide
CID 113014414
5-bromo-2-chloro-N-(6-morpholin-4-yl-3-pyridinyl)benzamide
CID 34442516
6-morpholin-4-yl-N-(4-phenoxyphenyl)pyridine-3-carboxamide
CID 109153445
4-(2,5-dioxopyrrolidin-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide
CID 18140140
3-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide;dihydrochloride
CID 119839707

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorobenzoyl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide?
The IUPAC name of 2-(4-fluorobenzoyl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide (CID 46553100) is 2-(4-fluorobenzoyl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide.
What is the SMILES notation for 2-(4-fluorobenzoyl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide?
The canonical SMILES for 2-(4-fluorobenzoyl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide is O=C(Nc1ccc(N2CCOCC2)nc1)c1ccccc1C(=O)c1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorobenzoyl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide?
The InChIKey is ZIKIIASPQPEZQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20FN3O3/c24-17-7-5-16(6-8-17)22(28)19-3-1-2-4-20(19)23(29)26-18-9-10-21(25-15-18)27-11-13-30-14-12-27/h1-10,15H,11-14H2,(H,26,29).
What are the key properties of 2-(4-fluorobenzoyl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide?
2-(4-fluorobenzoyl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide has a molecular weight of 405.43 g/mol, XLogP of 3.54, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorobenzoyl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide is sourced from PubChem (CID 46553100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).