N-cyclopentyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide

C12H19N3O3 — CID 146082804

IUPACN-cyclopentyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide
SMILESCC(C)c1noc(=O)n1CC(=O)NC1CCCC1
InChIInChI=1S/C12H19N3O3/c1-8(2)11-14-18-12(17)15(11)7-10(16)13-9-5-3-4-6-9/h8-9H,3-7H2,1-2H3,(H,13,16)
InChIKeyDAYTYSQVNQUKBT-UHFFFAOYSA-N
MW253.30 g/mol
LogP1.02
Rot. Bonds4

About N-cyclopentyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide

N-cyclopentyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide (PubChem CID 146082804) has the molecular formula C12H19N3O3 and a molecular weight of 253.30 g/mol. Its IUPAC name is N-cyclopentyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide
PubChem CID146082804
Molecular FormulaC12H19N3O3
Molecular Weight253.30 g/mol
Exact Mass253.14
IUPAC NameN-cyclopentyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide
SMILESCC(C)c1noc(=O)n1CC(=O)NC1CCCC1
InChIInChI=1S/C12H19N3O3/c1-8(2)11-14-18-12(17)15(11)7-10(16)13-9-5-3-4-6-9/h8-9H,3-7H2,1-2H3,(H,13,16)
InChIKeyDAYTYSQVNQUKBT-UHFFFAOYSA-N
XLogP1.02
TPSA77.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-methylhexan-2-yl)-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide
CID 146075518
2-(3-tert-butyl-5-oxo-1,2,4-oxadiazol-4-yl)-N-cyclopentylacetamide
CID 146082727
2-(3-tert-butyl-5-oxo-1,2,4-oxadiazol-4-yl)-N-propan-2-ylacetamide
CID 146082763
N-cyclopentyl-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide
CID 146082768
2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)-N-propan-2-ylacetamide
CID 146082823
N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide
CID 154796898

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide?
The IUPAC name of N-cyclopentyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide (CID 146082804) is N-cyclopentyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide.
What is the SMILES notation for N-cyclopentyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide?
The canonical SMILES for N-cyclopentyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide is CC(C)c1noc(=O)n1CC(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide?
The InChIKey is DAYTYSQVNQUKBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3/c1-8(2)11-14-18-12(17)15(11)7-10(16)13-9-5-3-4-6-9/h8-9H,3-7H2,1-2H3,(H,13,16).
What are the key properties of N-cyclopentyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide?
N-cyclopentyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide has a molecular weight of 253.30 g/mol, XLogP of 1.02, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide is sourced from PubChem (CID 146082804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).