(2S)-1-(5-bromopyrazolo[1,5-a]pyridin-6-yl)oxypropan-2-ol

C10H11BrN2O2 — CID 172631825

IUPAC(2S)-1-(5-bromopyrazolo[1,5-a]pyridin-6-yl)oxypropan-2-ol
SMILESC[C@H](O)COc1cn2nccc2cc1Br
InChIInChI=1S/C10H11BrN2O2/c1-7(14)6-15-10-5-13-8(2-3-12-13)4-9(10)11/h2-5,7,14H,6H2,1H3/t7-/m0/s1
InChIKeyYNSFIFSQMHWZEB-ZETCQYMHSA-N
MW271.11 g/mol
LogP1.86
Rot. Bonds3

About (2S)-1-(5-bromopyrazolo[1,5-a]pyridin-6-yl)oxypropan-2-ol

(2S)-1-(5-bromopyrazolo[1,5-a]pyridin-6-yl)oxypropan-2-ol (PubChem CID 172631825) has the molecular formula C10H11BrN2O2 and a molecular weight of 271.11 g/mol. Its IUPAC name is (2S)-1-(5-bromopyrazolo[1,5-a]pyridin-6-yl)oxypropan-2-ol.

Molecular Properties

Compound Name(2S)-1-(5-bromopyrazolo[1,5-a]pyridin-6-yl)oxypropan-2-ol
PubChem CID172631825
Molecular FormulaC10H11BrN2O2
Molecular Weight271.11 g/mol
Exact Mass270.00
IUPAC Name(2S)-1-(5-bromopyrazolo[1,5-a]pyridin-6-yl)oxypropan-2-ol
SMILESC[C@H](O)COc1cn2nccc2cc1Br
InChIInChI=1S/C10H11BrN2O2/c1-7(14)6-15-10-5-13-8(2-3-12-13)4-9(10)11/h2-5,7,14H,6H2,1H3/t7-/m0/s1
InChIKeyYNSFIFSQMHWZEB-ZETCQYMHSA-N
XLogP1.86
TPSA46.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.11
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-1-(2-bromophenoxy)propan-2-ol
CID 106933011
CID 175907618
CID 175907618
(2S)-1-(4-bromo-2-chlorophenoxy)propan-2-ol
CID 106933022
1-(2-methoxyphenoxy)propan-2-ol
CID 22036327
1-(2-bromo-5-nitrophenoxy)propan-2-ol
CID 103011922
1-[(2-bromo-4,5-dimethyl-1,3-benzothiazol-6-yl)oxy]propan-2-ol
CID 134181291
4-(2-hydroxypropoxy)benzene-1,3-dicarboxylic acid
CID 139699918
1-(2,6-dibromo-4-methylphenoxy)propan-2-ol
CID 129065841
1-(3-bromo-4-methylphenoxy)propan-2-ol
CID 130815670
(2S)-1-(4-bromo-3-methylphenoxy)propan-2-ol
CID 106933180
2-amino-1-pyrazolo[1,5-a]pyridin-6-ylpropan-1-ol
CID 112709589
1-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]propan-2-ol
CID 60885810

Frequently Asked Questions

What is the IUPAC name of (2S)-1-(5-bromopyrazolo[1,5-a]pyridin-6-yl)oxypropan-2-ol?
The IUPAC name of (2S)-1-(5-bromopyrazolo[1,5-a]pyridin-6-yl)oxypropan-2-ol (CID 172631825) is (2S)-1-(5-bromopyrazolo[1,5-a]pyridin-6-yl)oxypropan-2-ol.
What is the SMILES notation for (2S)-1-(5-bromopyrazolo[1,5-a]pyridin-6-yl)oxypropan-2-ol?
The canonical SMILES for (2S)-1-(5-bromopyrazolo[1,5-a]pyridin-6-yl)oxypropan-2-ol is C[C@H](O)COc1cn2nccc2cc1Br.
What is the InChIKey of (2S)-1-(5-bromopyrazolo[1,5-a]pyridin-6-yl)oxypropan-2-ol?
The InChIKey is YNSFIFSQMHWZEB-ZETCQYMHSA-N. The full InChI is InChI=1S/C10H11BrN2O2/c1-7(14)6-15-10-5-13-8(2-3-12-13)4-9(10)11/h2-5,7,14H,6H2,1H3/t7-/m0/s1.
What are the key properties of (2S)-1-(5-bromopyrazolo[1,5-a]pyridin-6-yl)oxypropan-2-ol?
(2S)-1-(5-bromopyrazolo[1,5-a]pyridin-6-yl)oxypropan-2-ol has a molecular weight of 271.11 g/mol, XLogP of 1.86, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-(5-bromopyrazolo[1,5-a]pyridin-6-yl)oxypropan-2-ol is sourced from PubChem (CID 172631825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).