N-(2-bromo-3-pyridinyl)-2-pyridin-3-ylacetamide

C12H10BrN3O — CID 103819165

IUPACN-(2-bromo-3-pyridinyl)-2-pyridin-3-ylacetamide
SMILESO=C(Cc1cccnc1)Nc1cccnc1Br
InChIInChI=1S/C12H10BrN3O/c13-12-10(4-2-6-15-12)16-11(17)7-9-3-1-5-14-8-9/h1-6,8H,7H2,(H,16,17)
InChIKeyPRIWMIRKPRNZOM-UHFFFAOYSA-N
MW292.14 g/mol
LogP2.42
Rot. Bonds3

About N-(2-bromo-3-pyridinyl)-2-pyridin-3-ylacetamide

N-(2-bromo-3-pyridinyl)-2-pyridin-3-ylacetamide (PubChem CID 103819165) has the molecular formula C12H10BrN3O and a molecular weight of 292.14 g/mol. Its IUPAC name is N-(2-bromo-3-pyridinyl)-2-pyridin-3-ylacetamide.

Molecular Properties

Compound NameN-(2-bromo-3-pyridinyl)-2-pyridin-3-ylacetamide
PubChem CID103819165
Molecular FormulaC12H10BrN3O
Molecular Weight292.14 g/mol
Exact Mass291.00
IUPAC NameN-(2-bromo-3-pyridinyl)-2-pyridin-3-ylacetamide
SMILESO=C(Cc1cccnc1)Nc1cccnc1Br
InChIInChI=1S/C12H10BrN3O/c13-12-10(4-2-6-15-12)16-11(17)7-9-3-1-5-14-8-9/h1-6,8H,7H2,(H,16,17)
InChIKeyPRIWMIRKPRNZOM-UHFFFAOYSA-N
XLogP2.42
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.14
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-(3-bromo-5-chloro-2-hydroxyphenyl)-2-pyridin-3-ylacetamide
CID 71978991
4-bromo-2-[(2-pyridin-3-ylacetyl)amino]benzoic acid
CID 62691044
2-[(2-pyridin-3-ylacetyl)amino]benzenesulfonyl fluoride
CID 116814254
2-pyridin-3-yl-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)acetamide
CID 166192558
N-(2-bromo-3-pyridinyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 103943345
N-(5-chloropyrazin-2-yl)-2-pyridin-3-ylacetamide
CID 107595873
N-[2-(3-aminoprop-1-ynyl)phenyl]-2-pyridin-3-ylacetamide
CID 62689712
CID 66868100
CID 66868100
N-(2,6-difluorophenyl)-2-pyridin-3-ylacetamide
CID 110697216
N-(2-bromo-3-pyridinyl)-3-(2-methylphenyl)propanamide
CID 103819476
2-[(2-phenylacetyl)amino]-N-(pyridin-3-ylmethyl)benzamide
CID 2986089
N-(2-bromo-3-pyridinyl)-2-(2-methoxyethoxy)acetamide
CID 103819290

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-3-pyridinyl)-2-pyridin-3-ylacetamide?
The IUPAC name of N-(2-bromo-3-pyridinyl)-2-pyridin-3-ylacetamide (CID 103819165) is N-(2-bromo-3-pyridinyl)-2-pyridin-3-ylacetamide.
What is the SMILES notation for N-(2-bromo-3-pyridinyl)-2-pyridin-3-ylacetamide?
The canonical SMILES for N-(2-bromo-3-pyridinyl)-2-pyridin-3-ylacetamide is O=C(Cc1cccnc1)Nc1cccnc1Br.
What is the InChIKey of N-(2-bromo-3-pyridinyl)-2-pyridin-3-ylacetamide?
The InChIKey is PRIWMIRKPRNZOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrN3O/c13-12-10(4-2-6-15-12)16-11(17)7-9-3-1-5-14-8-9/h1-6,8H,7H2,(H,16,17).
What are the key properties of N-(2-bromo-3-pyridinyl)-2-pyridin-3-ylacetamide?
N-(2-bromo-3-pyridinyl)-2-pyridin-3-ylacetamide has a molecular weight of 292.14 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-3-pyridinyl)-2-pyridin-3-ylacetamide is sourced from PubChem (CID 103819165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).