2,3-dichloro-N-(5-formyl-2-pyridinyl)benzamide

C13H8Cl2N2O2 — CID 54312256

IUPAC2,3-dichloro-N-(5-formyl-2-pyridinyl)benzamide
SMILESO=Cc1ccc(NC(=O)c2cccc(Cl)c2Cl)nc1
InChIInChI=1S/C13H8Cl2N2O2/c14-10-3-1-2-9(12(10)15)13(19)17-11-5-4-8(7-18)6-16-11/h1-7H,(H,16,17,19)
InChIKeyYXOGZLRTHKVLOF-UHFFFAOYSA-N
MW295.12 g/mol
LogP3.45
Rot. Bonds3

About 2,3-dichloro-N-(5-formyl-2-pyridinyl)benzamide

2,3-dichloro-N-(5-formyl-2-pyridinyl)benzamide (PubChem CID 54312256) has the molecular formula C13H8Cl2N2O2 and a molecular weight of 295.12 g/mol. Its IUPAC name is 2,3-dichloro-N-(5-formyl-2-pyridinyl)benzamide.

Molecular Properties

Compound Name2,3-dichloro-N-(5-formyl-2-pyridinyl)benzamide
PubChem CID54312256
Molecular FormulaC13H8Cl2N2O2
Molecular Weight295.12 g/mol
Exact Mass294.00
IUPAC Name2,3-dichloro-N-(5-formyl-2-pyridinyl)benzamide
SMILESO=Cc1ccc(NC(=O)c2cccc(Cl)c2Cl)nc1
InChIInChI=1S/C13H8Cl2N2O2/c14-10-3-1-2-9(12(10)15)13(19)17-11-5-4-8(7-18)6-16-11/h1-7H,(H,16,17,19)
InChIKeyYXOGZLRTHKVLOF-UHFFFAOYSA-N
XLogP3.45
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.12
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-(2-chlorophenyl)-N-(5-formyl-2-pyridinyl)acetamide
CID 57251088
N-(5-formyl-2-pyridinyl)benzamide
CID 159048742
2,3-dichloro-N-(6-chloropyrazin-2-yl)benzamide
CID 113229005
N-(5-acetamido-2-pyridinyl)-2-chlorobenzamide
CID 1449171
2,3-dichloro-N-phenylbenzamide
CID 7732866
6-(2,3-dichlorophenyl)pyridine-3-carbaldehyde
CID 24730313
[2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl] 2,3-dichlorobenzoate
CID 2617414
3-chloro-N-(5-iodo-2-pyridinyl)-2-methylbenzamide
CID 107096909
3-amino-2-chloro-N-(5-fluoro-2-pyridinyl)benzamide
CID 112576003
methyl 2-[(2,3-dichlorobenzoyl)amino]-1,3-thiazole-5-carboxylate
CID 18101566
6-[(3-chloro-2-fluorobenzoyl)amino]pyridine-3-carboxylic acid
CID 81267592
2-chloro-N-isoquinolin-3-ylbenzamide
CID 5237288

Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-N-(5-formyl-2-pyridinyl)benzamide?
The IUPAC name of 2,3-dichloro-N-(5-formyl-2-pyridinyl)benzamide (CID 54312256) is 2,3-dichloro-N-(5-formyl-2-pyridinyl)benzamide.
What is the SMILES notation for 2,3-dichloro-N-(5-formyl-2-pyridinyl)benzamide?
The canonical SMILES for 2,3-dichloro-N-(5-formyl-2-pyridinyl)benzamide is O=Cc1ccc(NC(=O)c2cccc(Cl)c2Cl)nc1.
What is the InChIKey of 2,3-dichloro-N-(5-formyl-2-pyridinyl)benzamide?
The InChIKey is YXOGZLRTHKVLOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Cl2N2O2/c14-10-3-1-2-9(12(10)15)13(19)17-11-5-4-8(7-18)6-16-11/h1-7H,(H,16,17,19).
What are the key properties of 2,3-dichloro-N-(5-formyl-2-pyridinyl)benzamide?
2,3-dichloro-N-(5-formyl-2-pyridinyl)benzamide has a molecular weight of 295.12 g/mol, XLogP of 3.45, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-N-(5-formyl-2-pyridinyl)benzamide is sourced from PubChem (CID 54312256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).