[(2R)-1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrrolidin-2-yl]methanol

C11H13FN4O — CID 86686997

IUPAC[(2R)-1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrrolidin-2-yl]methanol
SMILESOC[C@H]1CCCN1c1nnc2ccc(F)cn12
InChIInChI=1S/C11H13FN4O/c12-8-3-4-10-13-14-11(16(10)6-8)15-5-1-2-9(15)7-17/h3-4,6,9,17H,1-2,5,7H2/t9-/m1/s1
InChIKeyFCNSKUHLKSNVIG-SECBINFHSA-N
MW236.25 g/mol
LogP0.83
Rot. Bonds2

About [(2R)-1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrrolidin-2-yl]methanol

[(2R)-1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrrolidin-2-yl]methanol (PubChem CID 86686997) has the molecular formula C11H13FN4O and a molecular weight of 236.25 g/mol. Its IUPAC name is [(2R)-1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[(2R)-1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrrolidin-2-yl]methanol
PubChem CID86686997
Molecular FormulaC11H13FN4O
Molecular Weight236.25 g/mol
Exact Mass236.11
IUPAC Name[(2R)-1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrrolidin-2-yl]methanol
SMILESOC[C@H]1CCCN1c1nnc2ccc(F)cn12
InChIInChI=1S/C11H13FN4O/c12-8-3-4-10-13-14-11(16(10)6-8)15-5-1-2-9(15)7-17/h3-4,6,9,17H,1-2,5,7H2/t9-/m1/s1
InChIKeyFCNSKUHLKSNVIG-SECBINFHSA-N
XLogP0.83
TPSA53.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.25
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [(2R)-1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrrolidin-2-yl]methanol with MolForge

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Related Compounds

1-(7-Methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanol
CID 322251
1-[Methyl([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)amino]butan-2-ol
CID 71976091
[(2S)-1-[3-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]methanol
CID 126469450
[(2S)-1-[3-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]methanol
CID 126469583
3-(6-Amino-(1,2,4)triazolo(4,3-a)pyridin-3-yl)propan-1-ol dihydrochloride
CID 145867291
1,2,4-Triazolo(4,3-a)pyridinium, 2,3-dihydro-3-oxo-1-beta-D-ribofuranosyl-
CID 494217
6-Fluoro-3-(2-pyrrolidin-1-yl-ethyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 86686945
6-Fluoro-3-piperidin-1-yl-[1,2,4]triazolo[4,3-a]pyridine
CID 86686951
6-Fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl-piperidin-4-ol
CID 86686988
(6-Fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-methyl-(2-triisopropylsilanyloxy-ethyl)-amine
CID 86686991
(S)-1-(6-Fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-pyrrolidin-3-ol
CID 86686992
6-Fluoro-3-((S)-3-triisopropylsilanyloxy-pyrrolidin-1-yl)-[1,2,4]triazolo[4,3-a]pyridine
CID 86686993

Frequently Asked Questions

What is the IUPAC name of [(2R)-1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrrolidin-2-yl]methanol?
The IUPAC name of [(2R)-1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrrolidin-2-yl]methanol (CID 86686997) is [(2R)-1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrrolidin-2-yl]methanol.
What is the SMILES notation for [(2R)-1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrrolidin-2-yl]methanol?
The canonical SMILES for [(2R)-1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrrolidin-2-yl]methanol is OC[C@H]1CCCN1c1nnc2ccc(F)cn12.
What is the InChIKey of [(2R)-1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrrolidin-2-yl]methanol?
The InChIKey is FCNSKUHLKSNVIG-SECBINFHSA-N. The full InChI is InChI=1S/C11H13FN4O/c12-8-3-4-10-13-14-11(16(10)6-8)15-5-1-2-9(15)7-17/h3-4,6,9,17H,1-2,5,7H2/t9-/m1/s1.
What are the key properties of [(2R)-1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrrolidin-2-yl]methanol?
[(2R)-1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrrolidin-2-yl]methanol has a molecular weight of 236.25 g/mol, XLogP of 0.83, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-(6-fluoro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)pyrrolidin-2-yl]methanol is sourced from PubChem (CID 86686997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).