2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide

C10H14N4O3S — CID 11558091

IUPAC2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide
SMILESCC(=O)N1CCN(c2ncc(C(=O)NO)s2)CC1
InChIInChI=1S/C10H14N4O3S/c1-7(15)13-2-4-14(5-3-13)10-11-6-8(18-10)9(16)12-17/h6,17H,2-5H2,1H3,(H,12,16)
InChIKeyVBVYLNNSKNPOQV-UHFFFAOYSA-N
MW270.31 g/mol
LogP-0.07
Rot. Bonds2

About 2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide

2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide (PubChem CID 11558091) has the molecular formula C10H14N4O3S and a molecular weight of 270.31 g/mol. Its IUPAC name is 2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide
PubChem CID11558091
Molecular FormulaC10H14N4O3S
Molecular Weight270.31 g/mol
Exact Mass270.08
IUPAC Name2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide
SMILESCC(=O)N1CCN(c2ncc(C(=O)NO)s2)CC1
InChIInChI=1S/C10H14N4O3S/c1-7(15)13-2-4-14(5-3-13)10-11-6-8(18-10)9(16)12-17/h6,17H,2-5H2,1H3,(H,12,16)
InChIKeyVBVYLNNSKNPOQV-UHFFFAOYSA-N
XLogP-0.07
TPSA85.77 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.31
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(4-Methyl-piperazin-1-yl)-thiazole-5-carboxylic acid hydroxyamide
CID 11572286
[2-(Ethylamino)-1,3-thiazol-5-yl]-(1,2-oxazolidin-2-yl)methanone
CID 86797132
[2-(Ethylamino)-1,3-thiazol-5-yl]-piperidin-1-ylmethanone
CID 97236851
4-[(2-Amino-1,3-thiazol-5-yl)carbonyl]-1-butylpiperazin-2-one
CID 124215181
(2-amino-1,3-thiazol-5-yl)-[(3S)-3-methyl-4-propan-2-ylpiperazin-1-yl]methanone
CID 125525751
2-(3-methyl-2-oxoimidazolidin-1-yl)-N-(3,3,3-trifluoropropyl)-1,3-thiazole-5-carboxamide
CID 132469550
N-hydroxy-2-[4-(trifluoromethylsulfonyl)piperazin-1-yl]-1,3-thiazole-5-carboxamide
CID 60051085
2-[4-[(2E,4E)-5-fluorohexa-2,4-dien-3-yl]sulfonylpiperazin-1-yl]-N-hydroxy-1,3-thiazole-5-carboxamide
CID 143108167
5-{[4-(2,2,2-Trifluoroethyl)piperazin-1-yl]carbonyl}-1,3-thiazol-2-amine
CID 124209983
N-[2-[di(propan-2-yl)amino]ethyl]-2-(ethylamino)-1,3-thiazole-5-carboxamide
CID 117081754
2-(ethylamino)-N-(2-morpholin-4-ylethyl)-1,3-thiazole-5-carboxamide
CID 117082667
2-(2-morpholin-4-ylethylamino)-N-propyl-1,3-thiazole-5-carboxamide
CID 117082836

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide (CID 11558091) is 2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide is CC(=O)N1CCN(c2ncc(C(=O)NO)s2)CC1.
What is the InChIKey of 2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide?
The InChIKey is VBVYLNNSKNPOQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O3S/c1-7(15)13-2-4-14(5-3-13)10-11-6-8(18-10)9(16)12-17/h6,17H,2-5H2,1H3,(H,12,16).
What are the key properties of 2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide?
2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide has a molecular weight of 270.31 g/mol, XLogP of -0.07, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 11558091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).