2,3,5,6-tetraphenylpiperazine-2,5-diol

C28H26N2O2 — CID 134846140

IUPAC2,3,5,6-tetraphenylpiperazine-2,5-diol
SMILESOC1(c2ccccc2)NC(c2ccccc2)C(O)(c2ccccc2)NC1c1ccccc1
InChIInChI=1S/C28H26N2O2/c31-27(23-17-9-3-10-18-23)25(21-13-5-1-6-14-21)29-28(32,24-19-11-4-12-20-24)26(30-27)22-15-7-2-8-16-22/h1-20,25-26,29-32H
InChIKeyXGTSZCJSBVBYRN-UHFFFAOYSA-N
MW422.53 g/mol
LogP4.35
Rot. Bonds4

About 2,3,5,6-tetraphenylpiperazine-2,5-diol

2,3,5,6-tetraphenylpiperazine-2,5-diol (PubChem CID 134846140) has the molecular formula C28H26N2O2 and a molecular weight of 422.53 g/mol. Its IUPAC name is 2,3,5,6-tetraphenylpiperazine-2,5-diol.

Molecular Properties

Compound Name2,3,5,6-tetraphenylpiperazine-2,5-diol
PubChem CID134846140
Molecular FormulaC28H26N2O2
Molecular Weight422.53 g/mol
Exact Mass422.20
IUPAC Name2,3,5,6-tetraphenylpiperazine-2,5-diol
SMILESOC1(c2ccccc2)NC(c2ccccc2)C(O)(c2ccccc2)NC1c1ccccc1
InChIInChI=1S/C28H26N2O2/c31-27(23-17-9-3-10-18-23)25(21-13-5-1-6-14-21)29-28(32,24-19-11-4-12-20-24)26(30-27)22-15-7-2-8-16-22/h1-20,25-26,29-32H
InChIKeyXGTSZCJSBVBYRN-UHFFFAOYSA-N
XLogP4.35
TPSA64.52 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.53
LogP ≤ 54.35
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

Pipradrol
CID 10083
(1R)-2-[[(3S,6S)-6-benzhydrylpiperidin-3-yl]amino]-1-(4-fluorophenyl)ethanol
CID 44450683
2-(Benzylamino)-1,2-diphenylethanol
CID 222507
2-[4-(Phenyl-piperazin-1-yl-methyl)-phenyl]-propan-2-ol
CID 10662763
4-(2-(Aminomethyl)phenyl)-1-benzhydrylpiperidin-4-ol
CID 44430023
2-(Benzylamino)-1,1-diphenyl-1-ethanol
CID 409243
2-(4-Benzhydrylpiperazin-1-yl)-1-phenylethanol
CID 2809776
(S)-1,1,2-Triphenyl-2-(piperidin-1-yl)ethanol
CID 2734573
(R)-(-)-2-Piperidino-1,1,2-triphenylethanol
CID 7022521
(S)-(-)-1,2,3,4-Tetrahydro-alpha,alpha-diphenyl-3-isoquinolinemethanol
CID 11141600
2-[2-(Benzylamino)ethylamino]-1,2-diphenylethanol
CID 236822
3-(4-Benzhydrylpiperazin-1-yl)-1-phenylpropan-1-ol
CID 4313601

Frequently Asked Questions

What is the IUPAC name of 2,3,5,6-tetraphenylpiperazine-2,5-diol?
The IUPAC name of 2,3,5,6-tetraphenylpiperazine-2,5-diol (CID 134846140) is 2,3,5,6-tetraphenylpiperazine-2,5-diol.
What is the SMILES notation for 2,3,5,6-tetraphenylpiperazine-2,5-diol?
The canonical SMILES for 2,3,5,6-tetraphenylpiperazine-2,5-diol is OC1(c2ccccc2)NC(c2ccccc2)C(O)(c2ccccc2)NC1c1ccccc1.
What is the InChIKey of 2,3,5,6-tetraphenylpiperazine-2,5-diol?
The InChIKey is XGTSZCJSBVBYRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H26N2O2/c31-27(23-17-9-3-10-18-23)25(21-13-5-1-6-14-21)29-28(32,24-19-11-4-12-20-24)26(30-27)22-15-7-2-8-16-22/h1-20,25-26,29-32H.
What are the key properties of 2,3,5,6-tetraphenylpiperazine-2,5-diol?
2,3,5,6-tetraphenylpiperazine-2,5-diol has a molecular weight of 422.53 g/mol, XLogP of 4.35, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5,6-tetraphenylpiperazine-2,5-diol is sourced from PubChem (CID 134846140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).