N-[1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(1,3,5-trimethylpyrazol-4-yl)oxyacetamide

C17H25N5O3 — CID 127459653

IUPACN-[1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(1,3,5-trimethylpyrazol-4-yl)oxyacetamide
SMILESCCc1nc(C2(NC(=O)COc3c(C)nn(C)c3C)CCCC2)no1
InChIInChI=1S/C17H25N5O3/c1-5-14-18-16(21-25-14)17(8-6-7-9-17)19-13(23)10-24-15-11(2)20-22(4)12(15)3/h5-10H2,1-4H3,(H,19,23)
InChIKeyOHBRHIRLGDMDNL-UHFFFAOYSA-N
MW347.42 g/mol
LogP1.95
Rot. Bonds6

About N-[1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(1,3,5-trimethylpyrazol-4-yl)oxyacetamide

N-[1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(1,3,5-trimethylpyrazol-4-yl)oxyacetamide (PubChem CID 127459653) has the molecular formula C17H25N5O3 and a molecular weight of 347.42 g/mol. Its IUPAC name is N-[1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(1,3,5-trimethylpyrazol-4-yl)oxyacetamide.

Molecular Properties

Compound NameN-[1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(1,3,5-trimethylpyrazol-4-yl)oxyacetamide
PubChem CID127459653
Molecular FormulaC17H25N5O3
Molecular Weight347.42 g/mol
Exact Mass347.20
IUPAC NameN-[1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(1,3,5-trimethylpyrazol-4-yl)oxyacetamide
SMILESCCc1nc(C2(NC(=O)COc3c(C)nn(C)c3C)CCCC2)no1
InChIInChI=1S/C17H25N5O3/c1-5-14-18-16(21-25-14)17(8-6-7-9-17)19-13(23)10-24-15-11(2)20-22(4)12(15)3/h5-10H2,1-4H3,(H,19,23)
InChIKeyOHBRHIRLGDMDNL-UHFFFAOYSA-N
XLogP1.95
TPSA95.07 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(1,3,5-trimethylpyrazol-4-yl)oxyacetamide?
The IUPAC name of N-[1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(1,3,5-trimethylpyrazol-4-yl)oxyacetamide (CID 127459653) is N-[1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(1,3,5-trimethylpyrazol-4-yl)oxyacetamide.
What is the SMILES notation for N-[1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(1,3,5-trimethylpyrazol-4-yl)oxyacetamide?
The canonical SMILES for N-[1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(1,3,5-trimethylpyrazol-4-yl)oxyacetamide is CCc1nc(C2(NC(=O)COc3c(C)nn(C)c3C)CCCC2)no1.
What is the InChIKey of N-[1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(1,3,5-trimethylpyrazol-4-yl)oxyacetamide?
The InChIKey is OHBRHIRLGDMDNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N5O3/c1-5-14-18-16(21-25-14)17(8-6-7-9-17)19-13(23)10-24-15-11(2)20-22(4)12(15)3/h5-10H2,1-4H3,(H,19,23).
What are the key properties of N-[1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(1,3,5-trimethylpyrazol-4-yl)oxyacetamide?
N-[1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(1,3,5-trimethylpyrazol-4-yl)oxyacetamide has a molecular weight of 347.42 g/mol, XLogP of 1.95, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(1,3,5-trimethylpyrazol-4-yl)oxyacetamide is sourced from PubChem (CID 127459653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).