N-[(2R)-2-hydroxypropyl]-5-oxopiperazine-2-carboxamide

C8H15N3O3 — CID 107437971

IUPACN-[(2R)-2-hydroxypropyl]-5-oxopiperazine-2-carboxamide
SMILESC[C@@H](O)CNC(=O)C1CNC(=O)CN1
InChIInChI=1S/C8H15N3O3/c1-5(12)2-11-8(14)6-3-10-7(13)4-9-6/h5-6,9,12H,2-4H2,1H3,(H,10,13)(H,11,14)/t5-,6?/m1/s1
InChIKeyMCNYGSOPOOKCKW-LWOQYNTDSA-N
MW201.23 g/mol
LogP-2.43
Rot. Bonds3

About N-[(2R)-2-hydroxypropyl]-5-oxopiperazine-2-carboxamide

N-[(2R)-2-hydroxypropyl]-5-oxopiperazine-2-carboxamide (PubChem CID 107437971) has the molecular formula C8H15N3O3 and a molecular weight of 201.23 g/mol. Its IUPAC name is N-[(2R)-2-hydroxypropyl]-5-oxopiperazine-2-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-hydroxypropyl]-5-oxopiperazine-2-carboxamide
PubChem CID107437971
Molecular FormulaC8H15N3O3
Molecular Weight201.23 g/mol
Exact Mass201.11
IUPAC NameN-[(2R)-2-hydroxypropyl]-5-oxopiperazine-2-carboxamide
SMILESC[C@@H](O)CNC(=O)C1CNC(=O)CN1
InChIInChI=1S/C8H15N3O3/c1-5(12)2-11-8(14)6-3-10-7(13)4-9-6/h5-6,9,12H,2-4H2,1H3,(H,10,13)(H,11,14)/t5-,6?/m1/s1
InChIKeyMCNYGSOPOOKCKW-LWOQYNTDSA-N
XLogP-2.43
TPSA90.46 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 5-2.43
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

(4S)-N-[(2R)-2-hydroxypropyl]-2-oxoimidazolidine-4-carboxamide
CID 131209001
N-(2-hydroxy-2-phenylethyl)-5-oxopiperazine-2-carboxamide
CID 74876403
N-(2-amino-2-oxoethyl)-5-oxopiperazine-2-carboxamide
CID 107433351
5-oxo-N-pentan-3-ylpiperazine-2-carboxamide
CID 107433338
N-[(2R)-2-hydroxypropyl]-6-oxopiperidine-3-carboxamide
CID 103884751
N-(2-chloroprop-2-enyl)-5-oxopiperazine-2-carboxamide
CID 107437561
N-(1-methoxypropan-2-yl)-5-oxopiperazine-2-carboxamide
CID 107433403
N-(3-hydroxybutyl)-N-methyl-5-oxopiperazine-2-carboxamide
CID 107437656
methyl 2-[(5-oxopiperazine-2-carbonyl)amino]propanoate
CID 107436041
N-(6-hydroxyhexyl)-5-oxopiperazine-2-carboxamide
CID 107842610
N-[2-ethyl-2-(hydroxymethyl)butyl]-5-oxopiperazine-2-carboxamide
CID 114164742
5-oxo-N-(2-pyrrol-1-ylethyl)piperazine-2-carboxamide
CID 106390933

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-hydroxypropyl]-5-oxopiperazine-2-carboxamide?
The IUPAC name of N-[(2R)-2-hydroxypropyl]-5-oxopiperazine-2-carboxamide (CID 107437971) is N-[(2R)-2-hydroxypropyl]-5-oxopiperazine-2-carboxamide.
What is the SMILES notation for N-[(2R)-2-hydroxypropyl]-5-oxopiperazine-2-carboxamide?
The canonical SMILES for N-[(2R)-2-hydroxypropyl]-5-oxopiperazine-2-carboxamide is C[C@@H](O)CNC(=O)C1CNC(=O)CN1.
What is the InChIKey of N-[(2R)-2-hydroxypropyl]-5-oxopiperazine-2-carboxamide?
The InChIKey is MCNYGSOPOOKCKW-LWOQYNTDSA-N. The full InChI is InChI=1S/C8H15N3O3/c1-5(12)2-11-8(14)6-3-10-7(13)4-9-6/h5-6,9,12H,2-4H2,1H3,(H,10,13)(H,11,14)/t5-,6?/m1/s1.
What are the key properties of N-[(2R)-2-hydroxypropyl]-5-oxopiperazine-2-carboxamide?
N-[(2R)-2-hydroxypropyl]-5-oxopiperazine-2-carboxamide has a molecular weight of 201.23 g/mol, XLogP of -2.43, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-hydroxypropyl]-5-oxopiperazine-2-carboxamide is sourced from PubChem (CID 107437971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).