N-(4-hydroxyphenyl)-5-oxopiperazine-2-carboxamide

C11H13N3O3 — CID 107434569

IUPACN-(4-hydroxyphenyl)-5-oxopiperazine-2-carboxamide
SMILESO=C1CNC(C(=O)Nc2ccc(O)cc2)CN1
InChIInChI=1S/C11H13N3O3/c15-8-3-1-7(2-4-8)14-11(17)9-5-13-10(16)6-12-9/h1-4,9,12,15H,5-6H2,(H,13,16)(H,14,17)
InChIKeyRZNXSRILLUERKW-UHFFFAOYSA-N
MW235.24 g/mol
LogP-0.58
Rot. Bonds2

About N-(4-hydroxyphenyl)-5-oxopiperazine-2-carboxamide

N-(4-hydroxyphenyl)-5-oxopiperazine-2-carboxamide (PubChem CID 107434569) has the molecular formula C11H13N3O3 and a molecular weight of 235.24 g/mol. Its IUPAC name is N-(4-hydroxyphenyl)-5-oxopiperazine-2-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxyphenyl)-5-oxopiperazine-2-carboxamide
PubChem CID107434569
Molecular FormulaC11H13N3O3
Molecular Weight235.24 g/mol
Exact Mass235.10
IUPAC NameN-(4-hydroxyphenyl)-5-oxopiperazine-2-carboxamide
SMILESO=C1CNC(C(=O)Nc2ccc(O)cc2)CN1
InChIInChI=1S/C11H13N3O3/c15-8-3-1-7(2-4-8)14-11(17)9-5-13-10(16)6-12-9/h1-4,9,12,15H,5-6H2,(H,13,16)(H,14,17)
InChIKeyRZNXSRILLUERKW-UHFFFAOYSA-N
XLogP-0.58
TPSA90.46 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.24
LogP ≤ 5-0.58
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

N-[4-(dimethylcarbamoyl)phenyl]-5-oxopiperazine-2-carboxamide
CID 107434210
N-(4-ethoxyphenyl)-5-oxopiperazine-2-carboxamide
CID 107433377
N-(1,3-dioxoisoindol-5-yl)-5-oxopiperazine-2-carboxamide
CID 107433664
N-(3-hydroxy-4-methoxyphenyl)-5-oxopiperazine-2-carboxamide
CID 107434576
N-[4-(cyanomethoxy)phenyl]-5-oxopiperazine-2-carboxamide
CID 107435712
N-[4-methyl-3-(trifluoromethyl)phenyl]-5-oxopiperazine-2-carboxamide
CID 107436129
N-(3-acetamido-4-methylphenyl)-5-oxopiperazine-2-carboxamide
CID 107434723
N-[4-(1,3,4-oxadiazol-2-yl)phenyl]-5-oxopiperazine-2-carboxamide
CID 107435761
N-(3-fluoro-4-nitrophenyl)-5-oxopiperazine-2-carboxamide
CID 107437353
N-(4-chloro-3-methoxyphenyl)-5-oxopiperazine-2-carboxamide
CID 107621868
N-[3-(methoxymethyl)phenyl]-5-oxopiperazine-2-carboxamide
CID 107434107
N-(2,6-diethylphenyl)-5-oxopiperazine-2-carboxamide
CID 107433398

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxyphenyl)-5-oxopiperazine-2-carboxamide?
The IUPAC name of N-(4-hydroxyphenyl)-5-oxopiperazine-2-carboxamide (CID 107434569) is N-(4-hydroxyphenyl)-5-oxopiperazine-2-carboxamide.
What is the SMILES notation for N-(4-hydroxyphenyl)-5-oxopiperazine-2-carboxamide?
The canonical SMILES for N-(4-hydroxyphenyl)-5-oxopiperazine-2-carboxamide is O=C1CNC(C(=O)Nc2ccc(O)cc2)CN1.
What is the InChIKey of N-(4-hydroxyphenyl)-5-oxopiperazine-2-carboxamide?
The InChIKey is RZNXSRILLUERKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O3/c15-8-3-1-7(2-4-8)14-11(17)9-5-13-10(16)6-12-9/h1-4,9,12,15H,5-6H2,(H,13,16)(H,14,17).
What are the key properties of N-(4-hydroxyphenyl)-5-oxopiperazine-2-carboxamide?
N-(4-hydroxyphenyl)-5-oxopiperazine-2-carboxamide has a molecular weight of 235.24 g/mol, XLogP of -0.58, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyphenyl)-5-oxopiperazine-2-carboxamide is sourced from PubChem (CID 107434569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).