(3R)-3-(3-hydroxyphenyl)piperazine-2,5-dione

C10H10N2O3 — CID 129499079

IUPAC(3R)-3-(3-hydroxyphenyl)piperazine-2,5-dione
SMILESO=C1CNC(=O)[C@@H](c2cccc(O)c2)N1
InChIInChI=1S/C10H10N2O3/c13-7-3-1-2-6(4-7)9-10(15)11-5-8(14)12-9/h1-4,9,13H,5H2,(H,11,15)(H,12,14)/t9-/m1/s1
InChIKeyIBUNVPFVMWRHOM-SECBINFHSA-N
MW206.20 g/mol
LogP-0.32
Rot. Bonds1

About (3R)-3-(3-hydroxyphenyl)piperazine-2,5-dione

(3R)-3-(3-hydroxyphenyl)piperazine-2,5-dione (PubChem CID 129499079) has the molecular formula C10H10N2O3 and a molecular weight of 206.20 g/mol. Its IUPAC name is (3R)-3-(3-hydroxyphenyl)piperazine-2,5-dione.

Molecular Properties

Compound Name(3R)-3-(3-hydroxyphenyl)piperazine-2,5-dione
PubChem CID129499079
Molecular FormulaC10H10N2O3
Molecular Weight206.20 g/mol
Exact Mass206.07
IUPAC Name(3R)-3-(3-hydroxyphenyl)piperazine-2,5-dione
SMILESO=C1CNC(=O)[C@@H](c2cccc(O)c2)N1
InChIInChI=1S/C10H10N2O3/c13-7-3-1-2-6(4-7)9-10(15)11-5-8(14)12-9/h1-4,9,13H,5H2,(H,11,15)(H,12,14)/t9-/m1/s1
InChIKeyIBUNVPFVMWRHOM-SECBINFHSA-N
XLogP-0.32
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.20
LogP ≤ 5-0.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-3-(4-hydroxyphenyl)piperazine-2,5-dione
CID 129497891
4-(3-hydroxyphenyl)pyrrolidin-2-one
CID 23345041
(4R)-4-(3-hydroxyphenyl)imidazolidin-2-one
CID 131198796
4-(3-hydroxyphenyl)-1,3-diazinan-2-one
CID 105445856
2-(3-hydroxyphenyl)-5-methylimidazolidin-4-one
CID 126989517
4-(3-hydroxyphenyl)-2-sulfanylidene-3,4,4a,6,7,8-hexahydropyrido[4,3-d]pyrimidin-5-one
CID 91242964
(4S)-4-(3-hydroxyphenyl)-1,3-oxazinan-2-one;hydrochloride
CID 171185449
3-cyclohexylphenol
CID 16036
4-(3-hydroxyphenyl)-6-methyl-2-oxo-N-pyridin-3-yl-3,4-dihydro-1H-pyrimidine-5-carboxamide
CID 23960769
3-pyrrolidin-3-ylphenol
CID 12937992
3-[4-(4-hydroxyphenyl)cyclohexyl]phenol
CID 167227782
4-(3-hydroxyphenyl)-5-methyl-1,3-oxazolidin-2-one
CID 131010786

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(3-hydroxyphenyl)piperazine-2,5-dione?
The IUPAC name of (3R)-3-(3-hydroxyphenyl)piperazine-2,5-dione (CID 129499079) is (3R)-3-(3-hydroxyphenyl)piperazine-2,5-dione.
What is the SMILES notation for (3R)-3-(3-hydroxyphenyl)piperazine-2,5-dione?
The canonical SMILES for (3R)-3-(3-hydroxyphenyl)piperazine-2,5-dione is O=C1CNC(=O)[C@@H](c2cccc(O)c2)N1.
What is the InChIKey of (3R)-3-(3-hydroxyphenyl)piperazine-2,5-dione?
The InChIKey is IBUNVPFVMWRHOM-SECBINFHSA-N. The full InChI is InChI=1S/C10H10N2O3/c13-7-3-1-2-6(4-7)9-10(15)11-5-8(14)12-9/h1-4,9,13H,5H2,(H,11,15)(H,12,14)/t9-/m1/s1.
What are the key properties of (3R)-3-(3-hydroxyphenyl)piperazine-2,5-dione?
(3R)-3-(3-hydroxyphenyl)piperazine-2,5-dione has a molecular weight of 206.20 g/mol, XLogP of -0.32, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(3-hydroxyphenyl)piperazine-2,5-dione is sourced from PubChem (CID 129499079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).