N-benzyl-2-[(4-fluorobenzoyl)-methylamino]benzamide

C22H19FN2O2 — CID 2989345

IUPACN-benzyl-2-[(4-fluorobenzoyl)-methylamino]benzamide
SMILESCN(C(=O)c1ccc(F)cc1)c1ccccc1C(=O)NCc1ccccc1
InChIInChI=1S/C22H19FN2O2/c1-25(22(27)17-11-13-18(23)14-12-17)20-10-6-5-9-19(20)21(26)24-15-16-7-3-2-4-8-16/h2-14H,15H2,1H3,(H,24,26)
InChIKeyUZBKXXOWVFPTGX-UHFFFAOYSA-N
MW362.40 g/mol
LogP4.03
Rot. Bonds5

About N-benzyl-2-[(4-fluorobenzoyl)-methylamino]benzamide

N-benzyl-2-[(4-fluorobenzoyl)-methylamino]benzamide (PubChem CID 2989345) has the molecular formula C22H19FN2O2 and a molecular weight of 362.40 g/mol. Its IUPAC name is N-benzyl-2-[(4-fluorobenzoyl)-methylamino]benzamide.

Molecular Properties

Compound NameN-benzyl-2-[(4-fluorobenzoyl)-methylamino]benzamide
PubChem CID2989345
Molecular FormulaC22H19FN2O2
Molecular Weight362.40 g/mol
Exact Mass362.14
IUPAC NameN-benzyl-2-[(4-fluorobenzoyl)-methylamino]benzamide
SMILESCN(C(=O)c1ccc(F)cc1)c1ccccc1C(=O)NCc1ccccc1
InChIInChI=1S/C22H19FN2O2/c1-25(22(27)17-11-13-18(23)14-12-17)20-10-6-5-9-19(20)21(26)24-15-16-7-3-2-4-8-16/h2-14H,15H2,1H3,(H,24,26)
InChIKeyUZBKXXOWVFPTGX-UHFFFAOYSA-N
XLogP4.03
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.40
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[(4-fluorobenzoyl)-methylamino]benzamide?
The IUPAC name of N-benzyl-2-[(4-fluorobenzoyl)-methylamino]benzamide (CID 2989345) is N-benzyl-2-[(4-fluorobenzoyl)-methylamino]benzamide.
What is the SMILES notation for N-benzyl-2-[(4-fluorobenzoyl)-methylamino]benzamide?
The canonical SMILES for N-benzyl-2-[(4-fluorobenzoyl)-methylamino]benzamide is CN(C(=O)c1ccc(F)cc1)c1ccccc1C(=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-[(4-fluorobenzoyl)-methylamino]benzamide?
The InChIKey is UZBKXXOWVFPTGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19FN2O2/c1-25(22(27)17-11-13-18(23)14-12-17)20-10-6-5-9-19(20)21(26)24-15-16-7-3-2-4-8-16/h2-14H,15H2,1H3,(H,24,26).
What are the key properties of N-benzyl-2-[(4-fluorobenzoyl)-methylamino]benzamide?
N-benzyl-2-[(4-fluorobenzoyl)-methylamino]benzamide has a molecular weight of 362.40 g/mol, XLogP of 4.03, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[(4-fluorobenzoyl)-methylamino]benzamide is sourced from PubChem (CID 2989345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).