[2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-4-methyl-1,3-oxazol-5-yl]methanol

C18H15FN4O2 — CID 10382482

IUPAC[2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-4-methyl-1,3-oxazol-5-yl]methanol
SMILESCc1nc(-c2nn(Cc3ccccc3F)c3ncccc23)oc1CO
InChIInChI=1S/C18H15FN4O2/c1-11-15(10-24)25-18(21-11)16-13-6-4-8-20-17(13)23(22-16)9-12-5-2-3-7-14(12)19/h2-8,24H,9-10H2,1H3
InChIKeyIBZGVQBWUGSRGN-UHFFFAOYSA-N
MW338.34 g/mol
LogP3.07
Rot. Bonds4

About [2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-4-methyl-1,3-oxazol-5-yl]methanol

[2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-4-methyl-1,3-oxazol-5-yl]methanol (PubChem CID 10382482) has the molecular formula C18H15FN4O2 and a molecular weight of 338.34 g/mol. Its IUPAC name is [2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-4-methyl-1,3-oxazol-5-yl]methanol.

Molecular Properties

Compound Name[2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-4-methyl-1,3-oxazol-5-yl]methanol
PubChem CID10382482
Molecular FormulaC18H15FN4O2
Molecular Weight338.34 g/mol
Exact Mass338.12
IUPAC Name[2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-4-methyl-1,3-oxazol-5-yl]methanol
SMILESCc1nc(-c2nn(Cc3ccccc3F)c3ncccc23)oc1CO
InChIInChI=1S/C18H15FN4O2/c1-11-15(10-24)25-18(21-11)16-13-6-4-8-20-17(13)23(22-16)9-12-5-2-3-7-14(12)19/h2-8,24H,9-10H2,1H3
InChIKeyIBZGVQBWUGSRGN-UHFFFAOYSA-N
XLogP3.07
TPSA76.97 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.34
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-4-methyl-1,3-oxazol-5-yl]methanol?
The IUPAC name of [2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-4-methyl-1,3-oxazol-5-yl]methanol (CID 10382482) is [2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-4-methyl-1,3-oxazol-5-yl]methanol.
What is the SMILES notation for [2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-4-methyl-1,3-oxazol-5-yl]methanol?
The canonical SMILES for [2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-4-methyl-1,3-oxazol-5-yl]methanol is Cc1nc(-c2nn(Cc3ccccc3F)c3ncccc23)oc1CO.
What is the InChIKey of [2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-4-methyl-1,3-oxazol-5-yl]methanol?
The InChIKey is IBZGVQBWUGSRGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN4O2/c1-11-15(10-24)25-18(21-11)16-13-6-4-8-20-17(13)23(22-16)9-12-5-2-3-7-14(12)19/h2-8,24H,9-10H2,1H3.
What are the key properties of [2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-4-methyl-1,3-oxazol-5-yl]methanol?
[2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-4-methyl-1,3-oxazol-5-yl]methanol has a molecular weight of 338.34 g/mol, XLogP of 3.07, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[1-[(2-fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]-4-methyl-1,3-oxazol-5-yl]methanol is sourced from PubChem (CID 10382482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).