2-[5-[2-fluoro-5-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]phenyl]-2-pyridinyl]propan-2-ol

C23H21FN4O — CID 69350335

IUPAC2-[5-[2-fluoro-5-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]phenyl]-2-pyridinyl]propan-2-ol
SMILESCc1cccc(-c2[nH]ncc2-c2ccc(F)c(-c3ccc(C(C)(C)O)nc3)c2)n1
InChIInChI=1S/C23H21FN4O/c1-14-5-4-6-20(27-14)22-18(13-26-28-22)15-7-9-19(24)17(11-15)16-8-10-21(25-12-16)23(2,3)29/h4-13,29H,1-3H3,(H,26,28)
InChIKeyDUCANCIKMDCABN-UHFFFAOYSA-N
MW388.45 g/mol
LogP4.88
Rot. Bonds4

About 2-[5-[2-fluoro-5-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]phenyl]-2-pyridinyl]propan-2-ol

2-[5-[2-fluoro-5-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]phenyl]-2-pyridinyl]propan-2-ol (PubChem CID 69350335) has the molecular formula C23H21FN4O and a molecular weight of 388.45 g/mol. Its IUPAC name is 2-[5-[2-fluoro-5-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]phenyl]-2-pyridinyl]propan-2-ol.

Molecular Properties

Compound Name2-[5-[2-fluoro-5-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]phenyl]-2-pyridinyl]propan-2-ol
PubChem CID69350335
Molecular FormulaC23H21FN4O
Molecular Weight388.45 g/mol
Exact Mass388.17
IUPAC Name2-[5-[2-fluoro-5-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]phenyl]-2-pyridinyl]propan-2-ol
SMILESCc1cccc(-c2[nH]ncc2-c2ccc(F)c(-c3ccc(C(C)(C)O)nc3)c2)n1
InChIInChI=1S/C23H21FN4O/c1-14-5-4-6-20(27-14)22-18(13-26-28-22)15-7-9-19(24)17(11-15)16-8-10-21(25-12-16)23(2,3)29/h4-13,29H,1-3H3,(H,26,28)
InChIKeyDUCANCIKMDCABN-UHFFFAOYSA-N
XLogP4.88
TPSA74.69 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.45
LogP ≤ 54.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[5-[2-fluoro-5-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]phenyl]-2-pyridinyl]propan-2-ol with MolForge

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Related Compounds

{4-[3-(4-Fluorophenyl)-1h-Pyrazol-4-Yl]pyridin-2-Yl}methanol
CID 71710905
2-(4-(2-Fluoro-5-(3-(6-methylpyridin-2-yl)-1H-pyrazol-4-yl)phenyl)-1H-pyrazol-1-yl)ethan-1-ol
CID 11703284
2-[3-methylphenyl]-4-(3-pyridin-2-yl-1H-pyrazol-4-yl)pyridine
CID 11716589
[4-[3-(4-Fluorophenyl)-1-methylpyrazol-4-yl]-2-pyridinyl]methanol
CID 73293373
2,6-difluoro-4-[4-[3-(1H-pyrazol-4-yl)phenyl]-3-pyridinyl]phenol
CID 122186022
4-[4-(1H-pyrazol-4-yl)quinolin-6-yl]-2-pyridin-2-ylbut-3-yn-2-ol
CID 162651748
US11242343, Example 71
CID 134327640
1-{[3-(4-fluorophenyl)-1-(4-methylphenyl)-1H-pyrazol-4-yl]methyl}-4-pyridin-2-ylpiperidin-4-ol
CID 16188210
1-(4-Fluorophenyl)-2-pyrazol-1-yl-1-(4-pyridin-4-ylphenyl)ethanol
CID 14988718
2-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl-(pyridin-2-ylmethyl)amino]butan-1-ol
CID 46984628
1-(2H-indazol-3-yl)-1-pyridin-2-ylethanol
CID 11470469
(1R)-2-{3-[3-(3,6-dimethyl-2-pyrazinyl)phenyl]-1H-pyrazol-1-yl}-1-phenylethanol
CID 31125679

Frequently Asked Questions

What is the IUPAC name of 2-[5-[2-fluoro-5-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]phenyl]-2-pyridinyl]propan-2-ol?
The IUPAC name of 2-[5-[2-fluoro-5-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]phenyl]-2-pyridinyl]propan-2-ol (CID 69350335) is 2-[5-[2-fluoro-5-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]phenyl]-2-pyridinyl]propan-2-ol.
What is the SMILES notation for 2-[5-[2-fluoro-5-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]phenyl]-2-pyridinyl]propan-2-ol?
The canonical SMILES for 2-[5-[2-fluoro-5-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]phenyl]-2-pyridinyl]propan-2-ol is Cc1cccc(-c2[nH]ncc2-c2ccc(F)c(-c3ccc(C(C)(C)O)nc3)c2)n1.
What is the InChIKey of 2-[5-[2-fluoro-5-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]phenyl]-2-pyridinyl]propan-2-ol?
The InChIKey is DUCANCIKMDCABN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21FN4O/c1-14-5-4-6-20(27-14)22-18(13-26-28-22)15-7-9-19(24)17(11-15)16-8-10-21(25-12-16)23(2,3)29/h4-13,29H,1-3H3,(H,26,28).
What are the key properties of 2-[5-[2-fluoro-5-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]phenyl]-2-pyridinyl]propan-2-ol?
2-[5-[2-fluoro-5-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]phenyl]-2-pyridinyl]propan-2-ol has a molecular weight of 388.45 g/mol, XLogP of 4.88, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[2-fluoro-5-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]phenyl]-2-pyridinyl]propan-2-ol is sourced from PubChem (CID 69350335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).