2-chloro-5-[(3-fluorobenzoyl)amino]-N-pyridin-3-ylbenzamide

C19H13ClFN3O2 — CID 44561875

IUPAC2-chloro-5-[(3-fluorobenzoyl)amino]-N-pyridin-3-ylbenzamide
SMILESO=C(Nc1ccc(Cl)c(C(=O)Nc2cccnc2)c1)c1cccc(F)c1
InChIInChI=1S/C19H13ClFN3O2/c20-17-7-6-14(23-18(25)12-3-1-4-13(21)9-12)10-16(17)19(26)24-15-5-2-8-22-11-15/h1-11H,(H,23,25)(H,24,26)
InChIKeyMKIXXPCHZHGLCB-UHFFFAOYSA-N
MW369.78 g/mol
LogP4.38
Rot. Bonds4

About 2-chloro-5-[(3-fluorobenzoyl)amino]-N-pyridin-3-ylbenzamide

2-chloro-5-[(3-fluorobenzoyl)amino]-N-pyridin-3-ylbenzamide (PubChem CID 44561875) has the molecular formula C19H13ClFN3O2 and a molecular weight of 369.78 g/mol. Its IUPAC name is 2-chloro-5-[(3-fluorobenzoyl)amino]-N-pyridin-3-ylbenzamide.

Molecular Properties

Compound Name2-chloro-5-[(3-fluorobenzoyl)amino]-N-pyridin-3-ylbenzamide
PubChem CID44561875
Molecular FormulaC19H13ClFN3O2
Molecular Weight369.78 g/mol
Exact Mass369.07
IUPAC Name2-chloro-5-[(3-fluorobenzoyl)amino]-N-pyridin-3-ylbenzamide
SMILESO=C(Nc1ccc(Cl)c(C(=O)Nc2cccnc2)c1)c1cccc(F)c1
InChIInChI=1S/C19H13ClFN3O2/c20-17-7-6-14(23-18(25)12-3-1-4-13(21)9-12)10-16(17)19(26)24-15-5-2-8-22-11-15/h1-11H,(H,23,25)(H,24,26)
InChIKeyMKIXXPCHZHGLCB-UHFFFAOYSA-N
XLogP4.38
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.78
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-chloro-5-[(3-fluorobenzoyl)amino]-N-pyridin-3-ylbenzamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-[(3-fluorobenzoyl)amino]-N-pyridin-3-ylbenzamide?
The IUPAC name of 2-chloro-5-[(3-fluorobenzoyl)amino]-N-pyridin-3-ylbenzamide (CID 44561875) is 2-chloro-5-[(3-fluorobenzoyl)amino]-N-pyridin-3-ylbenzamide.
What is the SMILES notation for 2-chloro-5-[(3-fluorobenzoyl)amino]-N-pyridin-3-ylbenzamide?
The canonical SMILES for 2-chloro-5-[(3-fluorobenzoyl)amino]-N-pyridin-3-ylbenzamide is O=C(Nc1ccc(Cl)c(C(=O)Nc2cccnc2)c1)c1cccc(F)c1.
What is the InChIKey of 2-chloro-5-[(3-fluorobenzoyl)amino]-N-pyridin-3-ylbenzamide?
The InChIKey is MKIXXPCHZHGLCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13ClFN3O2/c20-17-7-6-14(23-18(25)12-3-1-4-13(21)9-12)10-16(17)19(26)24-15-5-2-8-22-11-15/h1-11H,(H,23,25)(H,24,26).
What are the key properties of 2-chloro-5-[(3-fluorobenzoyl)amino]-N-pyridin-3-ylbenzamide?
2-chloro-5-[(3-fluorobenzoyl)amino]-N-pyridin-3-ylbenzamide has a molecular weight of 369.78 g/mol, XLogP of 4.38, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-[(3-fluorobenzoyl)amino]-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 44561875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).