1-[furan-2-yl-(4-phenylmethoxyphenyl)methyl]piperazine

C22H24N2O2 — CID 3763713

IUPAC1-[furan-2-yl-(4-phenylmethoxyphenyl)methyl]piperazine
SMILESc1ccc(COc2ccc(C(c3ccco3)N3CCNCC3)cc2)cc1
InChIInChI=1S/C22H24N2O2/c1-2-5-18(6-3-1)17-26-20-10-8-19(9-11-20)22(21-7-4-16-25-21)24-14-12-23-13-15-24/h1-11,16,22-23H,12-15,17H2
InChIKeyCZERIPQKZBPHFA-UHFFFAOYSA-N
MW348.45 g/mol
LogP3.85
Rot. Bonds6

About 1-[furan-2-yl-(4-phenylmethoxyphenyl)methyl]piperazine

1-[furan-2-yl-(4-phenylmethoxyphenyl)methyl]piperazine (PubChem CID 3763713) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is 1-[furan-2-yl-(4-phenylmethoxyphenyl)methyl]piperazine.

Molecular Properties

Compound Name1-[furan-2-yl-(4-phenylmethoxyphenyl)methyl]piperazine
PubChem CID3763713
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC Name1-[furan-2-yl-(4-phenylmethoxyphenyl)methyl]piperazine
SMILESc1ccc(COc2ccc(C(c3ccco3)N3CCNCC3)cc2)cc1
InChIInChI=1S/C22H24N2O2/c1-2-5-18(6-3-1)17-26-20-10-8-19(9-11-20)22(21-7-4-16-25-21)24-14-12-23-13-15-24/h1-11,16,22-23H,12-15,17H2
InChIKeyCZERIPQKZBPHFA-UHFFFAOYSA-N
XLogP3.85
TPSA37.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(4-methoxyphenyl)-(4-phenylmethoxyphenyl)methyl]piperazine
CID 3763712
1-[furan-2-yl-(3-methoxy-4-phenylmethoxyphenyl)methyl]-1,4-diazepane
CID 3443710
1-[(3-methylphenyl)-(4-phenylmethoxyphenyl)methyl]piperazine
CID 3765974
1-[(2,4-dichlorophenyl)-(4-phenylmethoxyphenyl)methyl]piperazine
CID 3779919
1-[(2,4-difluorophenyl)-(4-phenylmethoxyphenyl)methyl]piperazine
CID 3766274
1-[(5-chlorothiophen-2-yl)-(4-phenylmethoxyphenyl)methyl]-1,4-diazepane
CID 3795026
1-[(2,4-dimethoxyphenyl)-(4-phenylmethoxyphenyl)methyl]piperazine
CID 3321312
1-[(2-methoxyphenyl)-(4-phenylmethoxyphenyl)methyl]-1,4-diazepane
CID 3704373
(2R)-2-(4-phenylmethoxyphenyl)-2-piperazin-1-ylethanol;hydrochloride
CID 171183535
1-[(1S)-1-(4-phenylmethoxyphenyl)propyl]piperazine;dihydrochloride
CID 171281105
1-[(4-fluorophenyl)-(3-phenylmethoxyphenyl)methyl]piperazine
CID 4209262
1-[(S)-furan-2-yl-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]methyl]piperazine;hydrochloride
CID 171176921

Frequently Asked Questions

What is the IUPAC name of 1-[furan-2-yl-(4-phenylmethoxyphenyl)methyl]piperazine?
The IUPAC name of 1-[furan-2-yl-(4-phenylmethoxyphenyl)methyl]piperazine (CID 3763713) is 1-[furan-2-yl-(4-phenylmethoxyphenyl)methyl]piperazine.
What is the SMILES notation for 1-[furan-2-yl-(4-phenylmethoxyphenyl)methyl]piperazine?
The canonical SMILES for 1-[furan-2-yl-(4-phenylmethoxyphenyl)methyl]piperazine is c1ccc(COc2ccc(C(c3ccco3)N3CCNCC3)cc2)cc1.
What is the InChIKey of 1-[furan-2-yl-(4-phenylmethoxyphenyl)methyl]piperazine?
The InChIKey is CZERIPQKZBPHFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O2/c1-2-5-18(6-3-1)17-26-20-10-8-19(9-11-20)22(21-7-4-16-25-21)24-14-12-23-13-15-24/h1-11,16,22-23H,12-15,17H2.
What are the key properties of 1-[furan-2-yl-(4-phenylmethoxyphenyl)methyl]piperazine?
1-[furan-2-yl-(4-phenylmethoxyphenyl)methyl]piperazine has a molecular weight of 348.45 g/mol, XLogP of 3.85, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[furan-2-yl-(4-phenylmethoxyphenyl)methyl]piperazine is sourced from PubChem (CID 3763713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).