5-oxo-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]piperazine-2-carboxamide

C9H12N4O3S — CID 106381374

IUPAC5-oxo-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]piperazine-2-carboxamide
SMILESO=C1CNC(C(=O)NCc2csc(=O)[nH]2)CN1
InChIInChI=1S/C9H12N4O3S/c14-7-3-10-6(2-11-7)8(15)12-1-5-4-17-9(16)13-5/h4,6,10H,1-3H2,(H,11,14)(H,12,15)(H,13,16)
InChIKeyZTRRZJJDCKJCQZ-UHFFFAOYSA-N
MW256.29 g/mol
LogP-1.86
Rot. Bonds3

About 5-oxo-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]piperazine-2-carboxamide

5-oxo-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]piperazine-2-carboxamide (PubChem CID 106381374) has the molecular formula C9H12N4O3S and a molecular weight of 256.29 g/mol. Its IUPAC name is 5-oxo-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]piperazine-2-carboxamide.

Molecular Properties

Compound Name5-oxo-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]piperazine-2-carboxamide
PubChem CID106381374
Molecular FormulaC9H12N4O3S
Molecular Weight256.29 g/mol
Exact Mass256.06
IUPAC Name5-oxo-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]piperazine-2-carboxamide
SMILESO=C1CNC(C(=O)NCc2csc(=O)[nH]2)CN1
InChIInChI=1S/C9H12N4O3S/c14-7-3-10-6(2-11-7)8(15)12-1-5-4-17-9(16)13-5/h4,6,10H,1-3H2,(H,11,14)(H,12,15)(H,13,16)
InChIKeyZTRRZJJDCKJCQZ-UHFFFAOYSA-N
XLogP-1.86
TPSA103.09 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.29
LogP ≤ 5-1.86
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Analyze 5-oxo-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]piperazine-2-carboxamide with MolForge

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Related Compounds

N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CID 106381310
N-[(2-methyl-1,3-thiazol-4-yl)methyl]-5-oxopiperazine-2-carboxamide
CID 107435967
N-[(5-ethylthiophen-2-yl)methyl]-5-oxopiperazine-2-carboxamide
CID 114137130
5-oxo-N-(2-thiophen-3-ylethyl)piperazine-2-carboxamide
CID 107436034
N-[(1-methylpyrazol-3-yl)methyl]-5-oxopiperazine-2-carboxamide
CID 107437406
N-(2-amino-2-oxoethyl)-5-oxopiperazine-2-carboxamide
CID 107433351
2-(aminomethyl)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]cyclopentane-1-carboxamide
CID 113357249
N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
CID 106381202
2-[[(5-oxopiperazine-2-carbonyl)amino]methyl]pyridine-4-carboxylic acid
CID 107437307
5-oxo-N-[(4-sulfamoylphenyl)methyl]piperazine-2-carboxamide
CID 76890368
methyl 4-[[(5-oxopiperazine-2-carbonyl)amino]methyl]benzoate
CID 107435812
N-[[2-[(dimethylamino)methyl]phenyl]methyl]-5-oxopiperazine-2-carboxamide
CID 107435917

Frequently Asked Questions

What is the IUPAC name of 5-oxo-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]piperazine-2-carboxamide?
The IUPAC name of 5-oxo-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]piperazine-2-carboxamide (CID 106381374) is 5-oxo-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]piperazine-2-carboxamide.
What is the SMILES notation for 5-oxo-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]piperazine-2-carboxamide?
The canonical SMILES for 5-oxo-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]piperazine-2-carboxamide is O=C1CNC(C(=O)NCc2csc(=O)[nH]2)CN1.
What is the InChIKey of 5-oxo-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]piperazine-2-carboxamide?
The InChIKey is ZTRRZJJDCKJCQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O3S/c14-7-3-10-6(2-11-7)8(15)12-1-5-4-17-9(16)13-5/h4,6,10H,1-3H2,(H,11,14)(H,12,15)(H,13,16).
What are the key properties of 5-oxo-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]piperazine-2-carboxamide?
5-oxo-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]piperazine-2-carboxamide has a molecular weight of 256.29 g/mol, XLogP of -1.86, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]piperazine-2-carboxamide is sourced from PubChem (CID 106381374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).