1-(2-fluorophenyl)-1-(1-propylpyrazol-4-yl)propan-1-ol

C15H19FN2O — CID 112679355

IUPAC1-(2-fluorophenyl)-1-(1-propylpyrazol-4-yl)propan-1-ol
SMILESCCCn1cc(C(O)(CC)c2ccccc2F)cn1
InChIInChI=1S/C15H19FN2O/c1-3-9-18-11-12(10-17-18)15(19,4-2)13-7-5-6-8-14(13)16/h5-8,10-11,19H,3-4,9H2,1-2H3
InChIKeyNFXYCASWWTVRFP-UHFFFAOYSA-N
MW262.33 g/mol
LogP3.08
Rot. Bonds5

About 1-(2-fluorophenyl)-1-(1-propylpyrazol-4-yl)propan-1-ol

1-(2-fluorophenyl)-1-(1-propylpyrazol-4-yl)propan-1-ol (PubChem CID 112679355) has the molecular formula C15H19FN2O and a molecular weight of 262.33 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-1-(1-propylpyrazol-4-yl)propan-1-ol.

Molecular Properties

Compound Name1-(2-fluorophenyl)-1-(1-propylpyrazol-4-yl)propan-1-ol
PubChem CID112679355
Molecular FormulaC15H19FN2O
Molecular Weight262.33 g/mol
Exact Mass262.15
IUPAC Name1-(2-fluorophenyl)-1-(1-propylpyrazol-4-yl)propan-1-ol
SMILESCCCn1cc(C(O)(CC)c2ccccc2F)cn1
InChIInChI=1S/C15H19FN2O/c1-3-9-18-11-12(10-17-18)15(19,4-2)13-7-5-6-8-14(13)16/h5-8,10-11,19H,3-4,9H2,1-2H3
InChIKeyNFXYCASWWTVRFP-UHFFFAOYSA-N
XLogP3.08
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 ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2-fluorophenyl)-1-(1-propylpyrazol-4-yl)propan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1-methyl-5-phenyl-1H-pyrazol-4-yl)methanol
CID 2795476
4-[1-(2,2-Dimethylpropyl)pyrazol-4-yl]-9-(trifluoromethyl)fluoren-9-ol
CID 59492537
1-phenyl-2-(1H-pyrazol-1-yl)ethanol
CID 3245641
4-[1-(2-Methylpropyl)pyrazol-4-yl]-9-(trifluoromethyl)fluoren-9-ol
CID 59492700
4-(1-Ethylpyrazol-4-yl)-9-(trifluoromethyl)fluoren-9-ol
CID 59493199
2,5-Difluoro-4-[1-(2-hydroxy-2-methyl-propyl)-1H-pyrazol-4-yl]-phenol
CID 86722114
4-(1-methyl-1H-pyrazol-4-yl)phenol
CID 79001945
3-[3-(4-fluorophenyl)-4-(hydroxymethyl)-1H-pyrazol-1-yl]propanenitrile
CID 2068133
1-(3,4-Dimethylphenyl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]ethanol
CID 48076344
1-(3,4-Difluorophenyl)-2-[2-(4-methylpyrazol-1-yl)ethylamino]ethanol
CID 53621988
2-[4-[(4-Methylpyrazol-1-yl)methyl]piperidin-1-yl]-1-phenylethanol
CID 56780672
1-(4-Fluorophenyl)-2-[4-[(4-methylpyrazol-1-yl)methyl]piperidin-1-yl]ethanol
CID 56780676

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-1-(1-propylpyrazol-4-yl)propan-1-ol?
The IUPAC name of 1-(2-fluorophenyl)-1-(1-propylpyrazol-4-yl)propan-1-ol (CID 112679355) is 1-(2-fluorophenyl)-1-(1-propylpyrazol-4-yl)propan-1-ol.
What is the SMILES notation for 1-(2-fluorophenyl)-1-(1-propylpyrazol-4-yl)propan-1-ol?
The canonical SMILES for 1-(2-fluorophenyl)-1-(1-propylpyrazol-4-yl)propan-1-ol is CCCn1cc(C(O)(CC)c2ccccc2F)cn1.
What is the InChIKey of 1-(2-fluorophenyl)-1-(1-propylpyrazol-4-yl)propan-1-ol?
The InChIKey is NFXYCASWWTVRFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O/c1-3-9-18-11-12(10-17-18)15(19,4-2)13-7-5-6-8-14(13)16/h5-8,10-11,19H,3-4,9H2,1-2H3.
What are the key properties of 1-(2-fluorophenyl)-1-(1-propylpyrazol-4-yl)propan-1-ol?
1-(2-fluorophenyl)-1-(1-propylpyrazol-4-yl)propan-1-ol has a molecular weight of 262.33 g/mol, XLogP of 3.08, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-1-(1-propylpyrazol-4-yl)propan-1-ol is sourced from PubChem (CID 112679355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).