N-(5-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropanamide

C10H11BrN4O — CID 143929844

IUPACN-(5-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropanamide
SMILESCC(C)C(=O)Nc1nc2cccc(Br)n2n1
InChIInChI=1S/C10H11BrN4O/c1-6(2)9(16)13-10-12-8-5-3-4-7(11)15(8)14-10/h3-6H,1-2H3,(H,13,14,16)
InChIKeyCPSNFIBIKMPKPT-UHFFFAOYSA-N
MW283.13 g/mol
LogP2.09
Rot. Bonds2

About N-(5-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropanamide

N-(5-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropanamide (PubChem CID 143929844) has the molecular formula C10H11BrN4O and a molecular weight of 283.13 g/mol. Its IUPAC name is N-(5-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(5-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropanamide
PubChem CID143929844
Molecular FormulaC10H11BrN4O
Molecular Weight283.13 g/mol
Exact Mass282.01
IUPAC NameN-(5-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropanamide
SMILESCC(C)C(=O)Nc1nc2cccc(Br)n2n1
InChIInChI=1S/C10H11BrN4O/c1-6(2)9(16)13-10-12-8-5-3-4-7(11)15(8)14-10/h3-6H,1-2H3,(H,13,14,16)
InChIKeyCPSNFIBIKMPKPT-UHFFFAOYSA-N
XLogP2.09
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.13
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-N-[5-(2,2,2-trifluoroethoxy)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]propanamide
CID 110455640
N-(5-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-3-methoxybenzamide
CID 86643870
2-acetamido-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylic acid
CID 110455263
N-[5-[4-[(3-butylazetidin-1-yl)methyl]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-2-methylpropanamide
CID 134216793
2-phenyl-N-[5-(propan-2-ylamino)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide
CID 110455566
2-amino-2-(5-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)acetic acid
CID 83844924
methyl 6-[[4-[2-(2-methylpropanoylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]phenoxy]methyl]pyridine-3-carboxylate
CID 143929924
2-(5-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)benzoic acid
CID 117158379
N-[5-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
CID 59589894
N-(2,6-dimethylphenyl)-2-methylpropanamide;yttrium
CID 158388394
N-[(3-fluorophenyl)methyl]-1-methyl-5-[2-(2-methylpropanoylamino)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]indole-3-carboxamide
CID 170009816
2,2,2-trifluoro-N-[5-(2-methylimidazol-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]acetamide
CID 110455404

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropanamide?
The IUPAC name of N-(5-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropanamide (CID 143929844) is N-(5-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropanamide.
What is the SMILES notation for N-(5-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropanamide?
The canonical SMILES for N-(5-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropanamide is CC(C)C(=O)Nc1nc2cccc(Br)n2n1.
What is the InChIKey of N-(5-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropanamide?
The InChIKey is CPSNFIBIKMPKPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrN4O/c1-6(2)9(16)13-10-12-8-5-3-4-7(11)15(8)14-10/h3-6H,1-2H3,(H,13,14,16).
What are the key properties of N-(5-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropanamide?
N-(5-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropanamide has a molecular weight of 283.13 g/mol, XLogP of 2.09, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-methylpropanamide is sourced from PubChem (CID 143929844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).