1-(4-fluorophenyl)-2-[4-(furan-2-ylmethyl)piperazin-1-yl]ethanol

C17H21FN2O2 — CID 110883568

IUPAC1-(4-fluorophenyl)-2-[4-(furan-2-ylmethyl)piperazin-1-yl]ethanol
SMILESOC(CN1CCN(Cc2ccco2)CC1)c1ccc(F)cc1
InChIInChI=1S/C17H21FN2O2/c18-15-5-3-14(4-6-15)17(21)13-20-9-7-19(8-10-20)12-16-2-1-11-22-16/h1-6,11,17,21H,7-10,12-13H2
InChIKeyUPANEWBFDQPTMH-UHFFFAOYSA-N
MW304.37 g/mol
LogP2.27
Rot. Bonds5

About 1-(4-fluorophenyl)-2-[4-(furan-2-ylmethyl)piperazin-1-yl]ethanol

1-(4-fluorophenyl)-2-[4-(furan-2-ylmethyl)piperazin-1-yl]ethanol (PubChem CID 110883568) has the molecular formula C17H21FN2O2 and a molecular weight of 304.37 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-[4-(furan-2-ylmethyl)piperazin-1-yl]ethanol.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-[4-(furan-2-ylmethyl)piperazin-1-yl]ethanol
PubChem CID110883568
Molecular FormulaC17H21FN2O2
Molecular Weight304.37 g/mol
Exact Mass304.16
IUPAC Name1-(4-fluorophenyl)-2-[4-(furan-2-ylmethyl)piperazin-1-yl]ethanol
SMILESOC(CN1CCN(Cc2ccco2)CC1)c1ccc(F)cc1
InChIInChI=1S/C17H21FN2O2/c18-15-5-3-14(4-6-15)17(21)13-20-9-7-19(8-10-20)12-16-2-1-11-22-16/h1-6,11,17,21H,7-10,12-13H2
InChIKeyUPANEWBFDQPTMH-UHFFFAOYSA-N
XLogP2.27
TPSA39.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.37
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(4-fluorophenyl)-2-[4-(furan-2-ylmethyl)piperazin-1-yl]ethanol 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

2-[4-(2,2-difluoroethyl)piperazin-1-yl]-1-(4-fluorophenyl)ethanol
CID 110910508
1-(4-fluorophenyl)-2-morpholin-4-ylethanol
CID 3678809
1-(4-chlorophenyl)-2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]ethanol
CID 69054072
2-[4-[(3,5-difluorophenyl)methyl]piperazin-1-yl]-1-(furan-2-yl)ethanol;dihydrochloride
CID 71783363
N-[(4-fluorophenyl)methyl]-2-[4-(furan-2-ylmethyl)piperazin-1-yl]propanamide
CID 46674028
1-[4-[2-(4-fluorophenyl)-2-hydroxyethyl]piperazin-1-yl]propan-1-one
CID 110922561
(1S)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-1-(furan-2-yl)ethanol
CID 34514470
3-[4-[2-(4-fluorophenyl)-2-hydroxyethyl]piperazin-1-yl]phenol
CID 110883491
[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-[4-(furan-2-ylmethyl)piperazin-1-yl]methanone
CID 19515200
2-(4-benzylpiperazin-1-yl)-1-(furan-2-yl)ethanol
CID 71683705
1-[(3,4-difluorophenyl)methyl]-4-(furan-2-ylmethyl)piperazine
CID 3650083
2-[4-[2-(4-fluorophenyl)-2-hydroxyethyl]-1,4-diazepan-1-yl]-N,N-dimethylacetamide
CID 110889740

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-[4-(furan-2-ylmethyl)piperazin-1-yl]ethanol?
The IUPAC name of 1-(4-fluorophenyl)-2-[4-(furan-2-ylmethyl)piperazin-1-yl]ethanol (CID 110883568) is 1-(4-fluorophenyl)-2-[4-(furan-2-ylmethyl)piperazin-1-yl]ethanol.
What is the SMILES notation for 1-(4-fluorophenyl)-2-[4-(furan-2-ylmethyl)piperazin-1-yl]ethanol?
The canonical SMILES for 1-(4-fluorophenyl)-2-[4-(furan-2-ylmethyl)piperazin-1-yl]ethanol is OC(CN1CCN(Cc2ccco2)CC1)c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-2-[4-(furan-2-ylmethyl)piperazin-1-yl]ethanol?
The InChIKey is UPANEWBFDQPTMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21FN2O2/c18-15-5-3-14(4-6-15)17(21)13-20-9-7-19(8-10-20)12-16-2-1-11-22-16/h1-6,11,17,21H,7-10,12-13H2.
What are the key properties of 1-(4-fluorophenyl)-2-[4-(furan-2-ylmethyl)piperazin-1-yl]ethanol?
1-(4-fluorophenyl)-2-[4-(furan-2-ylmethyl)piperazin-1-yl]ethanol has a molecular weight of 304.37 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-[4-(furan-2-ylmethyl)piperazin-1-yl]ethanol is sourced from PubChem (CID 110883568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).