2-[(3-chlorobenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide

C20H16ClN3O2 — CID 6457396

IUPAC2-[(3-chlorobenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide
SMILESO=C(Nc1ccccc1C(=O)NCc1cccnc1)c1cccc(Cl)c1
InChIInChI=1S/C20H16ClN3O2/c21-16-7-3-6-15(11-16)19(25)24-18-9-2-1-8-17(18)20(26)23-13-14-5-4-10-22-12-14/h1-12H,13H2,(H,23,26)(H,24,25)
InChIKeyKDMJVKYHYDYXEM-UHFFFAOYSA-N
MW365.82 g/mol
LogP3.92
Rot. Bonds5

About 2-[(3-chlorobenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide

2-[(3-chlorobenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide (PubChem CID 6457396) has the molecular formula C20H16ClN3O2 and a molecular weight of 365.82 g/mol. Its IUPAC name is 2-[(3-chlorobenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name2-[(3-chlorobenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide
PubChem CID6457396
Molecular FormulaC20H16ClN3O2
Molecular Weight365.82 g/mol
Exact Mass365.09
IUPAC Name2-[(3-chlorobenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide
SMILESO=C(Nc1ccccc1C(=O)NCc1cccnc1)c1cccc(Cl)c1
InChIInChI=1S/C20H16ClN3O2/c21-16-7-3-6-15(11-16)19(25)24-18-9-2-1-8-17(18)20(26)23-13-14-5-4-10-22-12-14/h1-12H,13H2,(H,23,26)(H,24,25)
InChIKeyKDMJVKYHYDYXEM-UHFFFAOYSA-N
XLogP3.92
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.82
LogP ≤ 53.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-3-methyl-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide
CID 100500766
2-[(4-methoxybenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide
CID 991450
2-[(2-phenylacetyl)amino]-N-(pyridin-3-ylmethyl)benzamide
CID 2986089
3,4,5-trimethoxy-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide
CID 2803194
3-N-(5-chloro-2-methoxyphenyl)-1-N-(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide
CID 109055121
2-chloro-N-(pyridin-3-ylmethyl)benzamide
CID 669068
2-iodo-4-methyl-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide
CID 100525900
2-[[4-(morpholin-4-ylmethyl)benzoyl]amino]-N-(pyridin-3-ylmethyl)benzamide
CID 2986326
2-[[(Z)-2,3-diphenylprop-2-enoyl]amino]-N-(pyridin-3-ylmethyl)benzamide
CID 17200377
N-[2-[(4-chlorophenyl)methylcarbamoyl]-4-iodophenyl]pyridine-3-carboxamide
CID 1307020
5-N-(4-chloro-2-methylphenyl)-3-N-(pyridin-3-ylmethyl)pyridine-3,5-dicarboxamide
CID 109106048
N-(pyridin-3-ylmethyl)-2-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide
CID 1279662

Frequently Asked Questions

What is the IUPAC name of 2-[(3-chlorobenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide?
The IUPAC name of 2-[(3-chlorobenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide (CID 6457396) is 2-[(3-chlorobenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide.
What is the SMILES notation for 2-[(3-chlorobenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide?
The canonical SMILES for 2-[(3-chlorobenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide is O=C(Nc1ccccc1C(=O)NCc1cccnc1)c1cccc(Cl)c1.
What is the InChIKey of 2-[(3-chlorobenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide?
The InChIKey is KDMJVKYHYDYXEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16ClN3O2/c21-16-7-3-6-15(11-16)19(25)24-18-9-2-1-8-17(18)20(26)23-13-14-5-4-10-22-12-14/h1-12H,13H2,(H,23,26)(H,24,25).
What are the key properties of 2-[(3-chlorobenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide?
2-[(3-chlorobenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide has a molecular weight of 365.82 g/mol, XLogP of 3.92, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-chlorobenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide is sourced from PubChem (CID 6457396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).