3-acetamido-N-(5-chloro-2-pyridinyl)benzamide

C14H12ClN3O2 — CID 13177093

IUPAC3-acetamido-N-(5-chloro-2-pyridinyl)benzamide
SMILESCC(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1
InChIInChI=1S/C14H12ClN3O2/c1-9(19)17-12-4-2-3-10(7-12)14(20)18-13-6-5-11(15)8-16-13/h2-8H,1H3,(H,17,19)(H,16,18,20)
InChIKeyYRBICADORPQNSF-UHFFFAOYSA-N
MW289.72 g/mol
LogP2.95
Rot. Bonds3

About 3-acetamido-N-(5-chloro-2-pyridinyl)benzamide

3-acetamido-N-(5-chloro-2-pyridinyl)benzamide (PubChem CID 13177093) has the molecular formula C14H12ClN3O2 and a molecular weight of 289.72 g/mol. Its IUPAC name is 3-acetamido-N-(5-chloro-2-pyridinyl)benzamide.

Molecular Properties

Compound Name3-acetamido-N-(5-chloro-2-pyridinyl)benzamide
PubChem CID13177093
Molecular FormulaC14H12ClN3O2
Molecular Weight289.72 g/mol
Exact Mass289.06
IUPAC Name3-acetamido-N-(5-chloro-2-pyridinyl)benzamide
SMILESCC(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1
InChIInChI=1S/C14H12ClN3O2/c1-9(19)17-12-4-2-3-10(7-12)14(20)18-13-6-5-11(15)8-16-13/h2-8H,1H3,(H,17,19)(H,16,18,20)
InChIKeyYRBICADORPQNSF-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

3-benzamido-N-(5-chloro-2-pyridinyl)benzamide
CID 3929829
N-[5-(3-acetamidoanilino)-2-pyridinyl]-3-chlorobenzamide
CID 113035147
N-[3-[(5-chloro-2-pyridinyl)carbamoyl]phenyl]-1H-pyrazole-5-carboxamide
CID 75370264
3-acetamido-N-[5-(hydroxymethyl)-2-pyridinyl]benzamide
CID 82343720
N-[5-(3-acetylanilino)-2-pyridinyl]-4-chlorobenzamide
CID 113034983
N-(5-chloro-2-pyridinyl)-3-[(3-methylpyrrolidin-3-yl)carbamoylamino]benzamide
CID 166243490
N-(5-chloro-2-pyridinyl)-3-(pyrrolidin-3-ylcarbamoylamino)benzamide
CID 166338346
N-[5-(3-acetamidoanilino)-2-pyridinyl]benzamide
CID 113035126
N-(5-chloro-2-pyridinyl)-3-[[2-(dimethylamino)-1-(4-methylphenyl)ethyl]carbamoylamino]benzamide
CID 166355447
N-(3-acetamidophenyl)-3-chlorobenzamide
CID 669190
4,5-dichloro-1-N,2-N-bis(5-chloro-2-pyridinyl)benzene-1,2-dicarboxamide
CID 3421055
3-chloro-N-[3-[2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl]sulfanylphenyl]benzamide
CID 18913238

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-(5-chloro-2-pyridinyl)benzamide?
The IUPAC name of 3-acetamido-N-(5-chloro-2-pyridinyl)benzamide (CID 13177093) is 3-acetamido-N-(5-chloro-2-pyridinyl)benzamide.
What is the SMILES notation for 3-acetamido-N-(5-chloro-2-pyridinyl)benzamide?
The canonical SMILES for 3-acetamido-N-(5-chloro-2-pyridinyl)benzamide is CC(=O)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1.
What is the InChIKey of 3-acetamido-N-(5-chloro-2-pyridinyl)benzamide?
The InChIKey is YRBICADORPQNSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClN3O2/c1-9(19)17-12-4-2-3-10(7-12)14(20)18-13-6-5-11(15)8-16-13/h2-8H,1H3,(H,17,19)(H,16,18,20).
What are the key properties of 3-acetamido-N-(5-chloro-2-pyridinyl)benzamide?
3-acetamido-N-(5-chloro-2-pyridinyl)benzamide 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 3-acetamido-N-(5-chloro-2-pyridinyl)benzamide is sourced from PubChem (CID 13177093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).