2-cyclopentyl-N-methyl-N-[2-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]ethyl]acetamide

C19H25N3O2 — CID 53055620

IUPAC2-cyclopentyl-N-methyl-N-[2-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]ethyl]acetamide
SMILESCc1ccc(-c2nc(CCN(C)C(=O)CC3CCCC3)no2)cc1
InChIInChI=1S/C19H25N3O2/c1-14-7-9-16(10-8-14)19-20-17(21-24-19)11-12-22(2)18(23)13-15-5-3-4-6-15/h7-10,15H,3-6,11-13H2,1-2H3
InChIKeySSMKCNLCJGXFMC-UHFFFAOYSA-N
MW327.43 g/mol
LogP3.63
Rot. Bonds6

About 2-cyclopentyl-N-methyl-N-[2-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]ethyl]acetamide

2-cyclopentyl-N-methyl-N-[2-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]ethyl]acetamide (PubChem CID 53055620) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is 2-cyclopentyl-N-methyl-N-[2-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]ethyl]acetamide.

Molecular Properties

Compound Name2-cyclopentyl-N-methyl-N-[2-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]ethyl]acetamide
PubChem CID53055620
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC Name2-cyclopentyl-N-methyl-N-[2-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]ethyl]acetamide
SMILESCc1ccc(-c2nc(CCN(C)C(=O)CC3CCCC3)no2)cc1
InChIInChI=1S/C19H25N3O2/c1-14-7-9-16(10-8-14)19-20-17(21-24-19)11-12-22(2)18(23)13-15-5-3-4-6-15/h7-10,15H,3-6,11-13H2,1-2H3
InChIKeySSMKCNLCJGXFMC-UHFFFAOYSA-N
XLogP3.63
TPSA59.23 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-methyl-N-[2-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]ethyl]acetamide?
The IUPAC name of 2-cyclopentyl-N-methyl-N-[2-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]ethyl]acetamide (CID 53055620) is 2-cyclopentyl-N-methyl-N-[2-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]ethyl]acetamide.
What is the SMILES notation for 2-cyclopentyl-N-methyl-N-[2-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]ethyl]acetamide?
The canonical SMILES for 2-cyclopentyl-N-methyl-N-[2-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]ethyl]acetamide is Cc1ccc(-c2nc(CCN(C)C(=O)CC3CCCC3)no2)cc1.
What is the InChIKey of 2-cyclopentyl-N-methyl-N-[2-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]ethyl]acetamide?
The InChIKey is SSMKCNLCJGXFMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-14-7-9-16(10-8-14)19-20-17(21-24-19)11-12-22(2)18(23)13-15-5-3-4-6-15/h7-10,15H,3-6,11-13H2,1-2H3.
What are the key properties of 2-cyclopentyl-N-methyl-N-[2-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]ethyl]acetamide?
2-cyclopentyl-N-methyl-N-[2-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]ethyl]acetamide has a molecular weight of 327.43 g/mol, XLogP of 3.63, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-methyl-N-[2-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]ethyl]acetamide is sourced from PubChem (CID 53055620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).