N-cyclopentyl-2-[5-[2-(2-methoxyphenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl]acetamide

C19H23N3O3 — CID 75371436

IUPACN-cyclopentyl-2-[5-[2-(2-methoxyphenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl]acetamide
SMILESCOc1ccccc1C1CC1c1nc(CC(=O)NC2CCCC2)no1
InChIInChI=1S/C19H23N3O3/c1-24-16-9-5-4-8-13(16)14-10-15(14)19-21-17(22-25-19)11-18(23)20-12-6-2-3-7-12/h4-5,8-9,12,14-15H,2-3,6-7,10-11H2,1H3,(H,20,23)
InChIKeyRNSHVZAIFCOVNN-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.95
Rot. Bonds6

About N-cyclopentyl-2-[5-[2-(2-methoxyphenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl]acetamide

N-cyclopentyl-2-[5-[2-(2-methoxyphenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl]acetamide (PubChem CID 75371436) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-cyclopentyl-2-[5-[2-(2-methoxyphenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[5-[2-(2-methoxyphenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl]acetamide
PubChem CID75371436
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC NameN-cyclopentyl-2-[5-[2-(2-methoxyphenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl]acetamide
SMILESCOc1ccccc1C1CC1c1nc(CC(=O)NC2CCCC2)no1
InChIInChI=1S/C19H23N3O3/c1-24-16-9-5-4-8-13(16)14-10-15(14)19-21-17(22-25-19)11-18(23)20-12-6-2-3-7-12/h4-5,8-9,12,14-15H,2-3,6-7,10-11H2,1H3,(H,20,23)
InChIKeyRNSHVZAIFCOVNN-UHFFFAOYSA-N
XLogP2.95
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[5-[2-(2-methoxyphenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl]acetamide?
The IUPAC name of N-cyclopentyl-2-[5-[2-(2-methoxyphenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl]acetamide (CID 75371436) is N-cyclopentyl-2-[5-[2-(2-methoxyphenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[5-[2-(2-methoxyphenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl]acetamide?
The canonical SMILES for N-cyclopentyl-2-[5-[2-(2-methoxyphenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl]acetamide is COc1ccccc1C1CC1c1nc(CC(=O)NC2CCCC2)no1.
What is the InChIKey of N-cyclopentyl-2-[5-[2-(2-methoxyphenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl]acetamide?
The InChIKey is RNSHVZAIFCOVNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-24-16-9-5-4-8-13(16)14-10-15(14)19-21-17(22-25-19)11-18(23)20-12-6-2-3-7-12/h4-5,8-9,12,14-15H,2-3,6-7,10-11H2,1H3,(H,20,23).
What are the key properties of N-cyclopentyl-2-[5-[2-(2-methoxyphenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl]acetamide?
N-cyclopentyl-2-[5-[2-(2-methoxyphenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl]acetamide has a molecular weight of 341.41 g/mol, XLogP of 2.95, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[5-[2-(2-methoxyphenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl]acetamide is sourced from PubChem (CID 75371436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).