N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-piperazin-1-ylacetamide

C9H15N5O2 — CID 43162326

IUPACN-(5-methyl-1,3,4-oxadiazol-2-yl)-2-piperazin-1-ylacetamide
SMILESCc1nnc(NC(=O)CN2CCNCC2)o1
InChIInChI=1S/C9H15N5O2/c1-7-12-13-9(16-7)11-8(15)6-14-4-2-10-3-5-14/h10H,2-6H2,1H3,(H,11,13,15)
InChIKeyTYLPWYZBJFJMCZ-UHFFFAOYSA-N
MW225.25 g/mol
LogP-0.78
Rot. Bonds3

About N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-piperazin-1-ylacetamide

N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-piperazin-1-ylacetamide (PubChem CID 43162326) has the molecular formula C9H15N5O2 and a molecular weight of 225.25 g/mol. Its IUPAC name is N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-piperazin-1-ylacetamide.

Molecular Properties

Compound NameN-(5-methyl-1,3,4-oxadiazol-2-yl)-2-piperazin-1-ylacetamide
PubChem CID43162326
Molecular FormulaC9H15N5O2
Molecular Weight225.25 g/mol
Exact Mass225.12
IUPAC NameN-(5-methyl-1,3,4-oxadiazol-2-yl)-2-piperazin-1-ylacetamide
SMILESCc1nnc(NC(=O)CN2CCNCC2)o1
InChIInChI=1S/C9H15N5O2/c1-7-12-13-9(16-7)11-8(15)6-14-4-2-10-3-5-14/h10H,2-6H2,1H3,(H,11,13,15)
InChIKeyTYLPWYZBJFJMCZ-UHFFFAOYSA-N
XLogP-0.78
TPSA83.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 5-0.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-piperazin-1-ylacetamide?
The IUPAC name of N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-piperazin-1-ylacetamide (CID 43162326) is N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-piperazin-1-ylacetamide.
What is the SMILES notation for N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-piperazin-1-ylacetamide?
The canonical SMILES for N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-piperazin-1-ylacetamide is Cc1nnc(NC(=O)CN2CCNCC2)o1.
What is the InChIKey of N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-piperazin-1-ylacetamide?
The InChIKey is TYLPWYZBJFJMCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5O2/c1-7-12-13-9(16-7)11-8(15)6-14-4-2-10-3-5-14/h10H,2-6H2,1H3,(H,11,13,15).
What are the key properties of N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-piperazin-1-ylacetamide?
N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-piperazin-1-ylacetamide has a molecular weight of 225.25 g/mol, XLogP of -0.78, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-piperazin-1-ylacetamide is sourced from PubChem (CID 43162326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).