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

C19H13Cl2N3O2 — CID 11682482

IUPAC2-chloro-5-[(3-chlorobenzoyl)amino]-N-pyridin-3-ylbenzamide
SMILESO=C(Nc1ccc(Cl)c(C(=O)Nc2cccnc2)c1)c1cccc(Cl)c1
InChIInChI=1S/C19H13Cl2N3O2/c20-13-4-1-3-12(9-13)18(25)23-14-6-7-17(21)16(10-14)19(26)24-15-5-2-8-22-11-15/h1-11H,(H,23,25)(H,24,26)
InChIKeyYMGSLKNERWLDNK-UHFFFAOYSA-N
MW386.24 g/mol
LogP4.89
Rot. Bonds4

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

2-chloro-5-[(3-chlorobenzoyl)amino]-N-pyridin-3-ylbenzamide (PubChem CID 11682482) has the molecular formula C19H13Cl2N3O2 and a molecular weight of 386.24 g/mol. Its IUPAC name is 2-chloro-5-[(3-chlorobenzoyl)amino]-N-pyridin-3-ylbenzamide.

Molecular Properties

Compound Name2-chloro-5-[(3-chlorobenzoyl)amino]-N-pyridin-3-ylbenzamide
PubChem CID11682482
Molecular FormulaC19H13Cl2N3O2
Molecular Weight386.24 g/mol
Exact Mass385.04
IUPAC Name2-chloro-5-[(3-chlorobenzoyl)amino]-N-pyridin-3-ylbenzamide
SMILESO=C(Nc1ccc(Cl)c(C(=O)Nc2cccnc2)c1)c1cccc(Cl)c1
InChIInChI=1S/C19H13Cl2N3O2/c20-13-4-1-3-12(9-13)18(25)23-14-6-7-17(21)16(10-14)19(26)24-15-5-2-8-22-11-15/h1-11H,(H,23,25)(H,24,26)
InChIKeyYMGSLKNERWLDNK-UHFFFAOYSA-N
XLogP4.89
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.24
LogP ≤ 54.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-[(3-chlorobenzoyl)amino]-N-pyridin-3-ylbenzamide?
The IUPAC name of 2-chloro-5-[(3-chlorobenzoyl)amino]-N-pyridin-3-ylbenzamide (CID 11682482) is 2-chloro-5-[(3-chlorobenzoyl)amino]-N-pyridin-3-ylbenzamide.
What is the SMILES notation for 2-chloro-5-[(3-chlorobenzoyl)amino]-N-pyridin-3-ylbenzamide?
The canonical SMILES for 2-chloro-5-[(3-chlorobenzoyl)amino]-N-pyridin-3-ylbenzamide is O=C(Nc1ccc(Cl)c(C(=O)Nc2cccnc2)c1)c1cccc(Cl)c1.
What is the InChIKey of 2-chloro-5-[(3-chlorobenzoyl)amino]-N-pyridin-3-ylbenzamide?
The InChIKey is YMGSLKNERWLDNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13Cl2N3O2/c20-13-4-1-3-12(9-13)18(25)23-14-6-7-17(21)16(10-14)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-chlorobenzoyl)amino]-N-pyridin-3-ylbenzamide?
2-chloro-5-[(3-chlorobenzoyl)amino]-N-pyridin-3-ylbenzamide has a molecular weight of 386.24 g/mol, XLogP of 4.89, 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-chlorobenzoyl)amino]-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 11682482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).