N-(5-acetamido-2-pyridinyl)-2-chlorobenzamide

C14H12ClN3O2 — CID 1449171

IUPACN-(5-acetamido-2-pyridinyl)-2-chlorobenzamide
SMILESCC(=O)Nc1ccc(NC(=O)c2ccccc2Cl)nc1
InChIInChI=1S/C14H12ClN3O2/c1-9(19)17-10-6-7-13(16-8-10)18-14(20)11-4-2-3-5-12(11)15/h2-8H,1H3,(H,17,19)(H,16,18,20)
InChIKeyCAHBJNUDBGEMPZ-UHFFFAOYSA-N
MW289.72 g/mol
LogP2.95
Rot. Bonds3

About N-(5-acetamido-2-pyridinyl)-2-chlorobenzamide

N-(5-acetamido-2-pyridinyl)-2-chlorobenzamide (PubChem CID 1449171) has the molecular formula C14H12ClN3O2 and a molecular weight of 289.72 g/mol. Its IUPAC name is N-(5-acetamido-2-pyridinyl)-2-chlorobenzamide.

Molecular Properties

Compound NameN-(5-acetamido-2-pyridinyl)-2-chlorobenzamide
PubChem CID1449171
Molecular FormulaC14H12ClN3O2
Molecular Weight289.72 g/mol
Exact Mass289.06
IUPAC NameN-(5-acetamido-2-pyridinyl)-2-chlorobenzamide
SMILESCC(=O)Nc1ccc(NC(=O)c2ccccc2Cl)nc1
InChIInChI=1S/C14H12ClN3O2/c1-9(19)17-10-6-7-13(16-8-10)18-14(20)11-4-2-3-5-12(11)15/h2-8H,1H3,(H,17,19)(H,16,18,20)
InChIKeyCAHBJNUDBGEMPZ-UHFFFAOYSA-N
XLogP2.95
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.72
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[6-(4-acetamidoanilino)-3-pyridinyl]-2-chlorobenzamide
CID 113020563
N-[5-(tert-butylamino)-2-pyridinyl]-2-chlorobenzamide
CID 113030002
2-chloro-N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]benzamide
CID 113012299
N-[6-(3-acetylanilino)-3-pyridinyl]-2-chlorobenzamide
CID 113020334
2-chloro-N-[6-(pentylamino)-3-pyridinyl]benzamide
CID 113015233
2-chloro-N-[6-(2,6-difluoroanilino)-3-pyridinyl]benzamide
CID 113023141
2-chloro-N-[6-(3-hydroxypropylamino)-3-pyridinyl]benzamide
CID 28901836
N-[5-(2,3-dichloroanilino)-2-pyridinyl]-2-methoxybenzamide
CID 113036860
methyl 3-[[6-[(2-chlorobenzoyl)amino]-3-pyridinyl]amino]benzoate
CID 113035339
N-(3-acetamidophenyl)-2-chlorobenzamide
CID 792012
2-chloro-N-isoquinolin-3-ylbenzamide
CID 5237288
2-methyl-N-[5-(propan-2-ylamino)-2-pyridinyl]benzamide
CID 113023560

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2-pyridinyl)-2-chlorobenzamide?
The IUPAC name of N-(5-acetamido-2-pyridinyl)-2-chlorobenzamide (CID 1449171) is N-(5-acetamido-2-pyridinyl)-2-chlorobenzamide.
What is the SMILES notation for N-(5-acetamido-2-pyridinyl)-2-chlorobenzamide?
The canonical SMILES for N-(5-acetamido-2-pyridinyl)-2-chlorobenzamide is CC(=O)Nc1ccc(NC(=O)c2ccccc2Cl)nc1.
What is the InChIKey of N-(5-acetamido-2-pyridinyl)-2-chlorobenzamide?
The InChIKey is CAHBJNUDBGEMPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClN3O2/c1-9(19)17-10-6-7-13(16-8-10)18-14(20)11-4-2-3-5-12(11)15/h2-8H,1H3,(H,17,19)(H,16,18,20).
What are the key properties of N-(5-acetamido-2-pyridinyl)-2-chlorobenzamide?
N-(5-acetamido-2-pyridinyl)-2-chlorobenzamide has a molecular weight of 289.72 g/mol, XLogP of 2.95, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2-pyridinyl)-2-chlorobenzamide is sourced from PubChem (CID 1449171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).