4-amino-N-(3-bromo-2-pyridinyl)pyridine-3-carboxamide

C11H9BrN4O — CID 81245467

IUPAC4-amino-N-(3-bromo-2-pyridinyl)pyridine-3-carboxamide
SMILESNc1ccncc1C(=O)Nc1ncccc1Br
InChIInChI=1S/C11H9BrN4O/c12-8-2-1-4-15-10(8)16-11(17)7-6-14-5-3-9(7)13/h1-6H,(H2,13,14)(H,15,16,17)
InChIKeyUIDZDDPUAAXIKR-UHFFFAOYSA-N
MW293.12 g/mol
LogP2.07
Rot. Bonds2

About 4-amino-N-(3-bromo-2-pyridinyl)pyridine-3-carboxamide

4-amino-N-(3-bromo-2-pyridinyl)pyridine-3-carboxamide (PubChem CID 81245467) has the molecular formula C11H9BrN4O and a molecular weight of 293.12 g/mol. Its IUPAC name is 4-amino-N-(3-bromo-2-pyridinyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(3-bromo-2-pyridinyl)pyridine-3-carboxamide
PubChem CID81245467
Molecular FormulaC11H9BrN4O
Molecular Weight293.12 g/mol
Exact Mass292.00
IUPAC Name4-amino-N-(3-bromo-2-pyridinyl)pyridine-3-carboxamide
SMILESNc1ccncc1C(=O)Nc1ncccc1Br
InChIInChI=1S/C11H9BrN4O/c12-8-2-1-4-15-10(8)16-11(17)7-6-14-5-3-9(7)13/h1-6H,(H2,13,14)(H,15,16,17)
InChIKeyUIDZDDPUAAXIKR-UHFFFAOYSA-N
XLogP2.07
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.12
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-pyridin-2-ylpyridine-3-carboxamide
CID 81236875
2-amino-N-(3-bromo-2-pyridinyl)-3-chlorobenzamide
CID 115540802
N-(3-bromo-2-pyridinyl)-2-chlorofuran-3-carboxamide
CID 106685084
N-(3-bromo-2-pyridinyl)-2-methylsulfanylbenzamide
CID 79214209
4-amino-N-(4-bromo-2,3-dichlorophenyl)pyridine-3-carboxamide
CID 107793511
4-amino-N-(4-bromo-2,5-difluorophenyl)pyridine-3-carboxamide
CID 107616547
4-amino-N-naphthalen-2-ylpyridine-3-carboxamide
CID 81240881
4-amino-N-(2,6-diethylphenyl)pyridine-3-carboxamide
CID 81235051
4-amino-N-(4-bromo-2,6-difluorophenyl)pyridine-3-carboxamide
CID 81245018
4-amino-N-(3-fluorophenyl)pyridine-3-carboxamide
CID 81235930
N-(3-bromo-2-pyridinyl)-2,4-difluoro-5-methylbenzamide
CID 112696541
N-(3-amino-2-pyridinyl)-2-bromo-5-chlorobenzamide
CID 114027359

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(3-bromo-2-pyridinyl)pyridine-3-carboxamide?
The IUPAC name of 4-amino-N-(3-bromo-2-pyridinyl)pyridine-3-carboxamide (CID 81245467) is 4-amino-N-(3-bromo-2-pyridinyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-amino-N-(3-bromo-2-pyridinyl)pyridine-3-carboxamide?
The canonical SMILES for 4-amino-N-(3-bromo-2-pyridinyl)pyridine-3-carboxamide is Nc1ccncc1C(=O)Nc1ncccc1Br.
What is the InChIKey of 4-amino-N-(3-bromo-2-pyridinyl)pyridine-3-carboxamide?
The InChIKey is UIDZDDPUAAXIKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrN4O/c12-8-2-1-4-15-10(8)16-11(17)7-6-14-5-3-9(7)13/h1-6H,(H2,13,14)(H,15,16,17).
What are the key properties of 4-amino-N-(3-bromo-2-pyridinyl)pyridine-3-carboxamide?
4-amino-N-(3-bromo-2-pyridinyl)pyridine-3-carboxamide has a molecular weight of 293.12 g/mol, XLogP of 2.07, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(3-bromo-2-pyridinyl)pyridine-3-carboxamide is sourced from PubChem (CID 81245467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).