1-(5-bromopyrazolo[1,5-a]pyridin-3-yl)propan-2-one

C10H9BrN2O — CID 83900635

IUPAC1-(5-bromopyrazolo[1,5-a]pyridin-3-yl)propan-2-one
SMILESCC(=O)Cc1cnn2ccc(Br)cc12
InChIInChI=1S/C10H9BrN2O/c1-7(14)4-8-6-12-13-3-2-9(11)5-10(8)13/h2-3,5-6H,4H2,1H3
InChIKeyFFRLUFLQNVTLIP-UHFFFAOYSA-N
MW253.10 g/mol
LogP2.23
Rot. Bonds2

About 1-(5-bromopyrazolo[1,5-a]pyridin-3-yl)propan-2-one

1-(5-bromopyrazolo[1,5-a]pyridin-3-yl)propan-2-one (PubChem CID 83900635) has the molecular formula C10H9BrN2O and a molecular weight of 253.10 g/mol. Its IUPAC name is 1-(5-bromopyrazolo[1,5-a]pyridin-3-yl)propan-2-one.

Molecular Properties

Compound Name1-(5-bromopyrazolo[1,5-a]pyridin-3-yl)propan-2-one
PubChem CID83900635
Molecular FormulaC10H9BrN2O
Molecular Weight253.10 g/mol
Exact Mass251.99
IUPAC Name1-(5-bromopyrazolo[1,5-a]pyridin-3-yl)propan-2-one
SMILESCC(=O)Cc1cnn2ccc(Br)cc12
InChIInChI=1S/C10H9BrN2O/c1-7(14)4-8-6-12-13-3-2-9(11)5-10(8)13/h2-3,5-6H,4H2,1H3
InChIKeyFFRLUFLQNVTLIP-UHFFFAOYSA-N
XLogP2.23
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.10
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-bromopyrazolo[1,5-a]pyridin-3-yl)ethylidenehydrazine
CID 91514959
3-ethyl-5-methylpyrazolo[1,5-a]pyridine
CID 169164413
1-pyrazolo[1,5-a]pyridin-4-ylpropan-2-one
CID 83827376
1-(7-bromoimidazo[1,5-a]pyridin-3-yl)propan-2-one
CID 117254007
2-(5-bromopyrazolo[1,5-a]pyridin-3-yl)propan-1-amine
CID 83900924
5-bromo-N-[2-(hydroxymethyl)-2-methylbutyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 166672990
3-ethyl-5-methoxypyrazolo[1,5-a]pyridine
CID 169163749
3-bromopyrazolo[1,5-a]pyridine-5-carboxamide
CID 171597831
1-(5-bromo-2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)-2-methylpropan-1-one
CID 58493469
1-(5-bromopyrazolo[1,5-a]pyridin-2-yl)ethanone
CID 84700999
1-(5-bromo-1-ethylindol-3-yl)propan-2-one
CID 117195591
1-(tetrazolo[1,5-a]pyridin-7-yl)propan-2-one
CID 83827578

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromopyrazolo[1,5-a]pyridin-3-yl)propan-2-one?
The IUPAC name of 1-(5-bromopyrazolo[1,5-a]pyridin-3-yl)propan-2-one (CID 83900635) is 1-(5-bromopyrazolo[1,5-a]pyridin-3-yl)propan-2-one.
What is the SMILES notation for 1-(5-bromopyrazolo[1,5-a]pyridin-3-yl)propan-2-one?
The canonical SMILES for 1-(5-bromopyrazolo[1,5-a]pyridin-3-yl)propan-2-one is CC(=O)Cc1cnn2ccc(Br)cc12.
What is the InChIKey of 1-(5-bromopyrazolo[1,5-a]pyridin-3-yl)propan-2-one?
The InChIKey is FFRLUFLQNVTLIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrN2O/c1-7(14)4-8-6-12-13-3-2-9(11)5-10(8)13/h2-3,5-6H,4H2,1H3.
What are the key properties of 1-(5-bromopyrazolo[1,5-a]pyridin-3-yl)propan-2-one?
1-(5-bromopyrazolo[1,5-a]pyridin-3-yl)propan-2-one has a molecular weight of 253.10 g/mol, XLogP of 2.23, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromopyrazolo[1,5-a]pyridin-3-yl)propan-2-one is sourced from PubChem (CID 83900635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).