3-formamido-N-pyridin-3-ylbenzamide

C13H11N3O2 — CID 168654563

IUPAC3-formamido-N-pyridin-3-ylbenzamide
SMILESO=CNc1cccc(C(=O)Nc2cccnc2)c1
InChIInChI=1S/C13H11N3O2/c17-9-15-11-4-1-3-10(7-11)13(18)16-12-5-2-6-14-8-12/h1-9H,(H,15,17)(H,16,18)
InChIKeyRUJJSZDOHGTNCZ-UHFFFAOYSA-N
MW241.25 g/mol
LogP1.90
Rot. Bonds4

About 3-formamido-N-pyridin-3-ylbenzamide

3-formamido-N-pyridin-3-ylbenzamide (PubChem CID 168654563) has the molecular formula C13H11N3O2 and a molecular weight of 241.25 g/mol. Its IUPAC name is 3-formamido-N-pyridin-3-ylbenzamide.

Molecular Properties

Compound Name3-formamido-N-pyridin-3-ylbenzamide
PubChem CID168654563
Molecular FormulaC13H11N3O2
Molecular Weight241.25 g/mol
Exact Mass241.09
IUPAC Name3-formamido-N-pyridin-3-ylbenzamide
SMILESO=CNc1cccc(C(=O)Nc2cccnc2)c1
InChIInChI=1S/C13H11N3O2/c17-9-15-11-4-1-3-10(7-11)13(18)16-12-5-2-6-14-8-12/h1-9H,(H,15,17)(H,16,18)
InChIKeyRUJJSZDOHGTNCZ-UHFFFAOYSA-N
XLogP1.90
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-N,3-N-dipyridin-3-ylbenzene-1,3-dicarboxamide
CID 679756
ethane;3-methyl-N-pyridin-3-ylbenzamide
CID 145409327
3-phenyl-N-pyridin-3-ylbenzamide
CID 110723041
N-pyridin-3-ylbenzamide;dihydrochloride
CID 174671785
3-(dimethylamino)-N-pyridin-3-ylbenzamide
CID 23793187
3-[[3-(pyridin-3-ylcarbamoyl)phenyl]carbamoyl]pyrazine-2-carboxylic acid
CID 56763143
N-pyridin-3-yl-3-sulfamoylbenzamide
CID 164627954
3-[(E)-3-(hydroxyamino)-3-oxoprop-1-enyl]-N-pyridin-3-ylbenzamide
CID 23557297
3-(2,3-dihydroxypropylamino)-N-pyridin-3-ylbenzamide
CID 168597603
3,5-dichloro-N-pyridin-3-ylbenzamide
CID 1245821
4-hydroxy-N-pyridin-3-ylbenzamide
CID 15965764
N-[3-(cyclopropanecarbonyl)phenyl]pyridine-3-carboxamide
CID 82122759

Frequently Asked Questions

What is the IUPAC name of 3-formamido-N-pyridin-3-ylbenzamide?
The IUPAC name of 3-formamido-N-pyridin-3-ylbenzamide (CID 168654563) is 3-formamido-N-pyridin-3-ylbenzamide.
What is the SMILES notation for 3-formamido-N-pyridin-3-ylbenzamide?
The canonical SMILES for 3-formamido-N-pyridin-3-ylbenzamide is O=CNc1cccc(C(=O)Nc2cccnc2)c1.
What is the InChIKey of 3-formamido-N-pyridin-3-ylbenzamide?
The InChIKey is RUJJSZDOHGTNCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O2/c17-9-15-11-4-1-3-10(7-11)13(18)16-12-5-2-6-14-8-12/h1-9H,(H,15,17)(H,16,18).
What are the key properties of 3-formamido-N-pyridin-3-ylbenzamide?
3-formamido-N-pyridin-3-ylbenzamide has a molecular weight of 241.25 g/mol, XLogP of 1.90, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-formamido-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 168654563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).