1-[4-(2-amino-1,3-oxazole-4-carbonyl)piperazin-1-yl]ethanone

C10H14N4O3 — CID 110850382

IUPAC1-[4-(2-amino-1,3-oxazole-4-carbonyl)piperazin-1-yl]ethanone
SMILESCC(=O)N1CCN(C(=O)c2coc(N)n2)CC1
InChIInChI=1S/C10H14N4O3/c1-7(15)13-2-4-14(5-3-13)9(16)8-6-17-10(11)12-8/h6H,2-5H2,1H3,(H2,11,12)
InChIKeyWAJJVFSSSSCKST-UHFFFAOYSA-N
MW238.25 g/mol
LogP-0.44
Rot. Bonds1

About 1-[4-(2-amino-1,3-oxazole-4-carbonyl)piperazin-1-yl]ethanone

1-[4-(2-amino-1,3-oxazole-4-carbonyl)piperazin-1-yl]ethanone (PubChem CID 110850382) has the molecular formula C10H14N4O3 and a molecular weight of 238.25 g/mol. Its IUPAC name is 1-[4-(2-amino-1,3-oxazole-4-carbonyl)piperazin-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-(2-amino-1,3-oxazole-4-carbonyl)piperazin-1-yl]ethanone
PubChem CID110850382
Molecular FormulaC10H14N4O3
Molecular Weight238.25 g/mol
Exact Mass238.11
IUPAC Name1-[4-(2-amino-1,3-oxazole-4-carbonyl)piperazin-1-yl]ethanone
SMILESCC(=O)N1CCN(C(=O)c2coc(N)n2)CC1
InChIInChI=1S/C10H14N4O3/c1-7(15)13-2-4-14(5-3-13)9(16)8-6-17-10(11)12-8/h6H,2-5H2,1H3,(H2,11,12)
InChIKeyWAJJVFSSSSCKST-UHFFFAOYSA-N
XLogP-0.44
TPSA92.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 5-0.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2-amino-1,3-oxazol-4-yl)-[4-(2-fluorophenyl)piperazin-1-yl]methanone
CID 110854582
2-amino-1,3-oxazole-4-carboxamide
CID 21094800
1-[4-[2-[(4-benzylpiperidin-1-yl)methyl]-1,3-oxazole-4-carbonyl]piperazin-1-yl]ethanone
CID 46043550
(2-amino-1,3-oxazol-4-yl)-(2,3-dihydroindol-1-yl)methanone
CID 110857028
ethyl 4-(2-phenyl-1,3-oxazole-4-carbonyl)piperazine-1-carboxylate
CID 46896218
piperidin-1-yl-(2-propan-2-yl-1,3-oxazol-4-yl)methanone
CID 141385532
3-(4-acetyl-1,4-diazepane-1-carbonyl)-1,2-oxazole-5-carboxylic acid
CID 107369448
1-[4-(2-methyl-1,3-thiazole-4-carbonyl)piperazin-1-yl]ethanone
CID 47445163
1-[4-(6-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone
CID 103186798
[2-(1-amino-2-methylpropyl)-1,3-oxazol-4-yl]-(azepan-1-yl)methanone
CID 3847869
[2-(1-aminopropyl)-1,3-oxazol-4-yl]-pyrrolidin-1-ylmethanone
CID 3859728
1-[4-[2-(4-methylpiperazin-1-yl)pyrimidine-4-carbonyl]piperazin-1-yl]ethanone
CID 109302025

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-amino-1,3-oxazole-4-carbonyl)piperazin-1-yl]ethanone?
The IUPAC name of 1-[4-(2-amino-1,3-oxazole-4-carbonyl)piperazin-1-yl]ethanone (CID 110850382) is 1-[4-(2-amino-1,3-oxazole-4-carbonyl)piperazin-1-yl]ethanone.
What is the SMILES notation for 1-[4-(2-amino-1,3-oxazole-4-carbonyl)piperazin-1-yl]ethanone?
The canonical SMILES for 1-[4-(2-amino-1,3-oxazole-4-carbonyl)piperazin-1-yl]ethanone is CC(=O)N1CCN(C(=O)c2coc(N)n2)CC1.
What is the InChIKey of 1-[4-(2-amino-1,3-oxazole-4-carbonyl)piperazin-1-yl]ethanone?
The InChIKey is WAJJVFSSSSCKST-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O3/c1-7(15)13-2-4-14(5-3-13)9(16)8-6-17-10(11)12-8/h6H,2-5H2,1H3,(H2,11,12).
What are the key properties of 1-[4-(2-amino-1,3-oxazole-4-carbonyl)piperazin-1-yl]ethanone?
1-[4-(2-amino-1,3-oxazole-4-carbonyl)piperazin-1-yl]ethanone has a molecular weight of 238.25 g/mol, XLogP of -0.44, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-amino-1,3-oxazole-4-carbonyl)piperazin-1-yl]ethanone is sourced from PubChem (CID 110850382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).