2-[4-(2-cyclopent-2-en-1-ylacetyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide

C17H24N4O3 — CID 24572919

IUPAC2-[4-(2-cyclopent-2-en-1-ylacetyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCc1cc(NC(=O)CN2CCN(C(=O)CC3C=CCC3)CC2)no1
InChIInChI=1S/C17H24N4O3/c1-13-10-15(19-24-13)18-16(22)12-20-6-8-21(9-7-20)17(23)11-14-4-2-3-5-14/h2,4,10,14H,3,5-9,11-12H2,1H3,(H,18,19,22)
InChIKeyUQLHHWIHNWCSDJ-UHFFFAOYSA-N
MW332.40 g/mol
LogP1.42
Rot. Bonds5

About 2-[4-(2-cyclopent-2-en-1-ylacetyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide

2-[4-(2-cyclopent-2-en-1-ylacetyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide (PubChem CID 24572919) has the molecular formula C17H24N4O3 and a molecular weight of 332.40 g/mol. Its IUPAC name is 2-[4-(2-cyclopent-2-en-1-ylacetyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound Name2-[4-(2-cyclopent-2-en-1-ylacetyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
PubChem CID24572919
Molecular FormulaC17H24N4O3
Molecular Weight332.40 g/mol
Exact Mass332.18
IUPAC Name2-[4-(2-cyclopent-2-en-1-ylacetyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCc1cc(NC(=O)CN2CCN(C(=O)CC3C=CCC3)CC2)no1
InChIInChI=1S/C17H24N4O3/c1-13-10-15(19-24-13)18-16(22)12-20-6-8-21(9-7-20)17(23)11-14-4-2-3-5-14/h2,4,10,14H,3,5-9,11-12H2,1H3,(H,18,19,22)
InChIKeyUQLHHWIHNWCSDJ-UHFFFAOYSA-N
XLogP1.42
TPSA78.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[4-[[(2R)-3,4-dihydro-2H-pyran-2-yl]methyl]piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 129402874
2-(4-benzoylpiperazin-1-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 9223107
2-[4-[2-(4-chlorophenoxy)acetyl]piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 36781449
N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[(4-methylpiperazin-1-yl)methyl]piperidin-1-yl]acetamide
CID 56806097
N-(3-methyl-1,2-oxazol-5-yl)-2-[4-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]piperazin-1-yl]acetamide
CID 16596717
2-[4-[3-(4-tert-butylphenyl)propanoyl]piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 24572905
2-[4-(azetidin-3-yl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 66201612
2-(2,6-dimethylmorpholin-4-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 4882751
2-[4-(2-acetamidopropanoyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 24645151
2-[4-[2-(2-bromo-4,5-dimethoxyphenyl)acetyl]piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 24572927
2-[4-[2-(8-ethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetyl]piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 55480221
N-(5-methyl-1,2-oxazol-3-yl)-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]acetamide
CID 86908992

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-cyclopent-2-en-1-ylacetyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The IUPAC name of 2-[4-(2-cyclopent-2-en-1-ylacetyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide (CID 24572919) is 2-[4-(2-cyclopent-2-en-1-ylacetyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for 2-[4-(2-cyclopent-2-en-1-ylacetyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The canonical SMILES for 2-[4-(2-cyclopent-2-en-1-ylacetyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide is Cc1cc(NC(=O)CN2CCN(C(=O)CC3C=CCC3)CC2)no1.
What is the InChIKey of 2-[4-(2-cyclopent-2-en-1-ylacetyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The InChIKey is UQLHHWIHNWCSDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O3/c1-13-10-15(19-24-13)18-16(22)12-20-6-8-21(9-7-20)17(23)11-14-4-2-3-5-14/h2,4,10,14H,3,5-9,11-12H2,1H3,(H,18,19,22).
What are the key properties of 2-[4-(2-cyclopent-2-en-1-ylacetyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
2-[4-(2-cyclopent-2-en-1-ylacetyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide has a molecular weight of 332.40 g/mol, XLogP of 1.42, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-cyclopent-2-en-1-ylacetyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 24572919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).