4-chloro-N-[6-chloro-2-(2-chlorobenzoyl)-3-pyridinyl]benzamide

C19H11Cl3N2O2 — CID 21448734

IUPAC4-chloro-N-[6-chloro-2-(2-chlorobenzoyl)-3-pyridinyl]benzamide
SMILESO=C(Nc1ccc(Cl)nc1C(=O)c1ccccc1Cl)c1ccc(Cl)cc1
InChIInChI=1S/C19H11Cl3N2O2/c20-12-7-5-11(6-8-12)19(26)23-15-9-10-16(22)24-17(15)18(25)13-3-1-2-4-14(13)21/h1-10H,(H,23,26)
InChIKeyPOPCIZCOTQAXLQ-UHFFFAOYSA-N
MW405.67 g/mol
LogP5.53
Rot. Bonds4

About 4-chloro-N-[6-chloro-2-(2-chlorobenzoyl)-3-pyridinyl]benzamide

4-chloro-N-[6-chloro-2-(2-chlorobenzoyl)-3-pyridinyl]benzamide (PubChem CID 21448734) has the molecular formula C19H11Cl3N2O2 and a molecular weight of 405.67 g/mol. Its IUPAC name is 4-chloro-N-[6-chloro-2-(2-chlorobenzoyl)-3-pyridinyl]benzamide.

Molecular Properties

Compound Name4-chloro-N-[6-chloro-2-(2-chlorobenzoyl)-3-pyridinyl]benzamide
PubChem CID21448734
Molecular FormulaC19H11Cl3N2O2
Molecular Weight405.67 g/mol
Exact Mass403.99
IUPAC Name4-chloro-N-[6-chloro-2-(2-chlorobenzoyl)-3-pyridinyl]benzamide
SMILESO=C(Nc1ccc(Cl)nc1C(=O)c1ccccc1Cl)c1ccc(Cl)cc1
InChIInChI=1S/C19H11Cl3N2O2/c20-12-7-5-11(6-8-12)19(26)23-15-9-10-16(22)24-17(15)18(25)13-3-1-2-4-14(13)21/h1-10H,(H,23,26)
InChIKeyPOPCIZCOTQAXLQ-UHFFFAOYSA-N
XLogP5.53
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500405.67
LogP ≤ 55.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-(2-benzoyl-6-chloro-3-pyridinyl)benzamide
CID 21448723
2-chloro-N-(4-chlorophenyl)benzamide;4-chloro-N-(4-chlorophenyl)benzamide
CID 159735192
2-chloro-N-[4-[(4-chlorobenzoyl)amino]-2-methylphenyl]benzamide
CID 3135769
N-(2,6-dichloro-3-pyridinyl)-2-fluorobenzamide
CID 15121533
2-[[4-(4-chlorophenyl)sulfonylbenzoyl]amino]benzoate
CID 2252777
N-(6-chloropyridazin-3-yl)benzamide
CID 13125576
2,4-dichloro-N-[4-chloro-2-(2-chlorobenzoyl)phenyl]benzamide
CID 4029873
4-chloro-N-[2-[2-(4-fluorophenyl)-2-oxoacetyl]phenyl]benzamide
CID 66575367
3-[(3,6-dichloropyridine-2-carbonyl)amino]-4-fluorobenzoic acid
CID 60748759
N-(2-benzoyl-6-chloro-3-pyridinyl)propanethioamide
CID 21448755
ethyl 2-[[6-chloro-3-[(4-chlorobenzoyl)amino]-2-pyridinyl]amino]acetate
CID 15617222
2-[(4-chlorobenzoyl)amino]-N-(2-chlorophenyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 1468203

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[6-chloro-2-(2-chlorobenzoyl)-3-pyridinyl]benzamide?
The IUPAC name of 4-chloro-N-[6-chloro-2-(2-chlorobenzoyl)-3-pyridinyl]benzamide (CID 21448734) is 4-chloro-N-[6-chloro-2-(2-chlorobenzoyl)-3-pyridinyl]benzamide.
What is the SMILES notation for 4-chloro-N-[6-chloro-2-(2-chlorobenzoyl)-3-pyridinyl]benzamide?
The canonical SMILES for 4-chloro-N-[6-chloro-2-(2-chlorobenzoyl)-3-pyridinyl]benzamide is O=C(Nc1ccc(Cl)nc1C(=O)c1ccccc1Cl)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N-[6-chloro-2-(2-chlorobenzoyl)-3-pyridinyl]benzamide?
The InChIKey is POPCIZCOTQAXLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11Cl3N2O2/c20-12-7-5-11(6-8-12)19(26)23-15-9-10-16(22)24-17(15)18(25)13-3-1-2-4-14(13)21/h1-10H,(H,23,26).
What are the key properties of 4-chloro-N-[6-chloro-2-(2-chlorobenzoyl)-3-pyridinyl]benzamide?
4-chloro-N-[6-chloro-2-(2-chlorobenzoyl)-3-pyridinyl]benzamide has a molecular weight of 405.67 g/mol, XLogP of 5.53, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[6-chloro-2-(2-chlorobenzoyl)-3-pyridinyl]benzamide is sourced from PubChem (CID 21448734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).