[6-cyclopropyl-4-(4-fluorophenyl)-3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridin-5-yl]methanol

C22H19FN4O — CID 19829143

IUPAC[6-cyclopropyl-4-(4-fluorophenyl)-3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridin-5-yl]methanol
SMILESCc1nn(-c2ccccn2)c2nc(C3CC3)c(CO)c(-c3ccc(F)cc3)c12
InChIInChI=1S/C22H19FN4O/c1-13-19-20(14-7-9-16(23)10-8-14)17(12-28)21(15-5-6-15)25-22(19)27(26-13)18-4-2-3-11-24-18/h2-4,7-11,15,28H,5-6,12H2,1H3
InChIKeyNPRRHRODGXOVBS-UHFFFAOYSA-N
MW374.42 g/mol
LogP4.30
Rot. Bonds4

About [6-cyclopropyl-4-(4-fluorophenyl)-3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridin-5-yl]methanol

[6-cyclopropyl-4-(4-fluorophenyl)-3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridin-5-yl]methanol (PubChem CID 19829143) has the molecular formula C22H19FN4O and a molecular weight of 374.42 g/mol. Its IUPAC name is [6-cyclopropyl-4-(4-fluorophenyl)-3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridin-5-yl]methanol.

Molecular Properties

Compound Name[6-cyclopropyl-4-(4-fluorophenyl)-3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridin-5-yl]methanol
PubChem CID19829143
Molecular FormulaC22H19FN4O
Molecular Weight374.42 g/mol
Exact Mass374.15
IUPAC Name[6-cyclopropyl-4-(4-fluorophenyl)-3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridin-5-yl]methanol
SMILESCc1nn(-c2ccccn2)c2nc(C3CC3)c(CO)c(-c3ccc(F)cc3)c12
InChIInChI=1S/C22H19FN4O/c1-13-19-20(14-7-9-16(23)10-8-14)17(12-28)21(15-5-6-15)25-22(19)27(26-13)18-4-2-3-11-24-18/h2-4,7-11,15,28H,5-6,12H2,1H3
InChIKeyNPRRHRODGXOVBS-UHFFFAOYSA-N
XLogP4.30
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.42
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [6-cyclopropyl-4-(4-fluorophenyl)-3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridin-5-yl]methanol?
The IUPAC name of [6-cyclopropyl-4-(4-fluorophenyl)-3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridin-5-yl]methanol (CID 19829143) is [6-cyclopropyl-4-(4-fluorophenyl)-3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridin-5-yl]methanol.
What is the SMILES notation for [6-cyclopropyl-4-(4-fluorophenyl)-3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridin-5-yl]methanol?
The canonical SMILES for [6-cyclopropyl-4-(4-fluorophenyl)-3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridin-5-yl]methanol is Cc1nn(-c2ccccn2)c2nc(C3CC3)c(CO)c(-c3ccc(F)cc3)c12.
What is the InChIKey of [6-cyclopropyl-4-(4-fluorophenyl)-3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridin-5-yl]methanol?
The InChIKey is NPRRHRODGXOVBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19FN4O/c1-13-19-20(14-7-9-16(23)10-8-14)17(12-28)21(15-5-6-15)25-22(19)27(26-13)18-4-2-3-11-24-18/h2-4,7-11,15,28H,5-6,12H2,1H3.
What are the key properties of [6-cyclopropyl-4-(4-fluorophenyl)-3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridin-5-yl]methanol?
[6-cyclopropyl-4-(4-fluorophenyl)-3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridin-5-yl]methanol has a molecular weight of 374.42 g/mol, XLogP of 4.30, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-cyclopropyl-4-(4-fluorophenyl)-3-methyl-1-pyridin-2-ylpyrazolo[5,4-b]pyridin-5-yl]methanol is sourced from PubChem (CID 19829143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).