N-(2-aminophenyl)pyridine-2-carboxamide

C12H11N3O — CID 817096

IUPACN-(2-aminophenyl)pyridine-2-carboxamide
SMILESNc1ccccc1NC(=O)c1ccccn1
InChIInChI=1S/C12H11N3O/c13-9-5-1-2-6-10(9)15-12(16)11-7-3-4-8-14-11/h1-8H,13H2,(H,15,16)
InChIKeyXIQCXQUJFNTCCK-UHFFFAOYSA-N
MW213.24 g/mol
LogP1.92
Rot. Bonds2

About N-(2-aminophenyl)pyridine-2-carboxamide

N-(2-aminophenyl)pyridine-2-carboxamide (PubChem CID 817096) has the molecular formula C12H11N3O and a molecular weight of 213.24 g/mol. Its IUPAC name is N-(2-aminophenyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-aminophenyl)pyridine-2-carboxamide
PubChem CID817096
Molecular FormulaC12H11N3O
Molecular Weight213.24 g/mol
Exact Mass213.09
IUPAC NameN-(2-aminophenyl)pyridine-2-carboxamide
SMILESNc1ccccc1NC(=O)c1ccccn1
InChIInChI=1S/C12H11N3O/c13-9-5-1-2-6-10(9)15-12(16)11-7-3-4-8-14-11/h1-8H,13H2,(H,15,16)
InChIKeyXIQCXQUJFNTCCK-UHFFFAOYSA-N
XLogP1.92
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)pyridine-2-carboxamide?
The IUPAC name of N-(2-aminophenyl)pyridine-2-carboxamide (CID 817096) is N-(2-aminophenyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(2-aminophenyl)pyridine-2-carboxamide?
The canonical SMILES for N-(2-aminophenyl)pyridine-2-carboxamide is Nc1ccccc1NC(=O)c1ccccn1.
What is the InChIKey of N-(2-aminophenyl)pyridine-2-carboxamide?
The InChIKey is XIQCXQUJFNTCCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O/c13-9-5-1-2-6-10(9)15-12(16)11-7-3-4-8-14-11/h1-8H,13H2,(H,15,16).
What are the key properties of N-(2-aminophenyl)pyridine-2-carboxamide?
N-(2-aminophenyl)pyridine-2-carboxamide has a molecular weight of 213.24 g/mol, XLogP of 1.92, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminophenyl)pyridine-2-carboxamide is sourced from PubChem (CID 817096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).