1-(4-fluorophenyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-ol

C15H19FN2O — CID 64772608

IUPAC1-(4-fluorophenyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-ol
SMILESCC(C)n1ccc(CC(O)Cc2ccc(F)cc2)n1
InChIInChI=1S/C15H19FN2O/c1-11(2)18-8-7-14(17-18)10-15(19)9-12-3-5-13(16)6-4-12/h3-8,11,15,19H,9-10H2,1-2H3
InChIKeyUWVNERMENNHAGA-UHFFFAOYSA-N
MW262.33 g/mol
LogP2.75
Rot. Bonds5

About 1-(4-fluorophenyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-ol

1-(4-fluorophenyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-ol (PubChem CID 64772608) has the molecular formula C15H19FN2O and a molecular weight of 262.33 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-ol.

Molecular Properties

Compound Name1-(4-fluorophenyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-ol
PubChem CID64772608
Molecular FormulaC15H19FN2O
Molecular Weight262.33 g/mol
Exact Mass262.15
IUPAC Name1-(4-fluorophenyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-ol
SMILESCC(C)n1ccc(CC(O)Cc2ccc(F)cc2)n1
InChIInChI=1S/C15H19FN2O/c1-11(2)18-8-7-14(17-18)10-15(19)9-12-3-5-13(16)6-4-12/h3-8,11,15,19H,9-10H2,1-2H3
InChIKeyUWVNERMENNHAGA-UHFFFAOYSA-N
XLogP2.75
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-butan-2-ylpyrazol-3-yl)-3-(4-fluorophenyl)propan-2-ol
CID 64783184
3-methyl-4-(1-propan-2-ylpyrazol-3-yl)butan-2-ol
CID 64772656
1-propan-2-yloxy-3-(1-propan-2-ylpyrazol-3-yl)propan-2-ol
CID 105103444
1-(1-propan-2-ylpyrazol-3-yl)nonan-2-ol
CID 64770989
1-(4-fluorophenyl)-3-(4-methylphenyl)propan-2-ol
CID 60797629
2-[(4-methylphenyl)methyl]-3-(1-propan-2-ylpyrazol-3-yl)propan-1-ol
CID 66057568
2-[(1-propan-2-ylpyrazol-3-yl)methyl]propane-1,3-diol
CID 79449988
1-(3-bromo-5-fluorophenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanol
CID 66424827
2-[(4-bromophenyl)methyl]-3-(1-propan-2-ylpyrazol-3-yl)propan-1-ol
CID 66059261
1-(1-propan-2-ylpyrazol-3-yl)hexane-2,3-diol
CID 103454908
2-[(4-methoxyphenyl)methyl]-3-(1-propan-2-ylpyrazol-3-yl)propan-1-ol
CID 66059687
2-[(4-chlorophenyl)methyl]-3-(1-propan-2-ylpyrazol-3-yl)propanoic acid
CID 64771687

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-ol?
The IUPAC name of 1-(4-fluorophenyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-ol (CID 64772608) is 1-(4-fluorophenyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-ol.
What is the SMILES notation for 1-(4-fluorophenyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-ol?
The canonical SMILES for 1-(4-fluorophenyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-ol is CC(C)n1ccc(CC(O)Cc2ccc(F)cc2)n1.
What is the InChIKey of 1-(4-fluorophenyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-ol?
The InChIKey is UWVNERMENNHAGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O/c1-11(2)18-8-7-14(17-18)10-15(19)9-12-3-5-13(16)6-4-12/h3-8,11,15,19H,9-10H2,1-2H3.
What are the key properties of 1-(4-fluorophenyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-ol?
1-(4-fluorophenyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-ol has a molecular weight of 262.33 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-ol is sourced from PubChem (CID 64772608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).