2-(3-methyl-1,2-oxazol-5-yl)-N-[5-(3-oxocyclopentyl)-1,3-thiazol-2-yl]acetamide

C14H15N3O3S — CID 164880341

IUPAC2-(3-methyl-1,2-oxazol-5-yl)-N-[5-(3-oxocyclopentyl)-1,3-thiazol-2-yl]acetamide
SMILESCc1cc(CC(=O)Nc2ncc(C3CCC(=O)C3)s2)on1
InChIInChI=1S/C14H15N3O3S/c1-8-4-11(20-17-8)6-13(19)16-14-15-7-12(21-14)9-2-3-10(18)5-9/h4,7,9H,2-3,5-6H2,1H3,(H,15,16,19)
InChIKeyJDZXBKFVYYFKHU-UHFFFAOYSA-N
MW305.36 g/mol
LogP2.46
Rot. Bonds4

About 2-(3-methyl-1,2-oxazol-5-yl)-N-[5-(3-oxocyclopentyl)-1,3-thiazol-2-yl]acetamide

2-(3-methyl-1,2-oxazol-5-yl)-N-[5-(3-oxocyclopentyl)-1,3-thiazol-2-yl]acetamide (PubChem CID 164880341) has the molecular formula C14H15N3O3S and a molecular weight of 305.36 g/mol. Its IUPAC name is 2-(3-methyl-1,2-oxazol-5-yl)-N-[5-(3-oxocyclopentyl)-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound Name2-(3-methyl-1,2-oxazol-5-yl)-N-[5-(3-oxocyclopentyl)-1,3-thiazol-2-yl]acetamide
PubChem CID164880341
Molecular FormulaC14H15N3O3S
Molecular Weight305.36 g/mol
Exact Mass305.08
IUPAC Name2-(3-methyl-1,2-oxazol-5-yl)-N-[5-(3-oxocyclopentyl)-1,3-thiazol-2-yl]acetamide
SMILESCc1cc(CC(=O)Nc2ncc(C3CCC(=O)C3)s2)on1
InChIInChI=1S/C14H15N3O3S/c1-8-4-11(20-17-8)6-13(19)16-14-15-7-12(21-14)9-2-3-10(18)5-9/h4,7,9H,2-3,5-6H2,1H3,(H,15,16,19)
InChIKeyJDZXBKFVYYFKHU-UHFFFAOYSA-N
XLogP2.46
TPSA85.09 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.36
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-1,2-oxazol-5-yl)-N-[5-(3-oxocyclopentyl)-1,3-thiazol-2-yl]acetamide?
The IUPAC name of 2-(3-methyl-1,2-oxazol-5-yl)-N-[5-(3-oxocyclopentyl)-1,3-thiazol-2-yl]acetamide (CID 164880341) is 2-(3-methyl-1,2-oxazol-5-yl)-N-[5-(3-oxocyclopentyl)-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for 2-(3-methyl-1,2-oxazol-5-yl)-N-[5-(3-oxocyclopentyl)-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for 2-(3-methyl-1,2-oxazol-5-yl)-N-[5-(3-oxocyclopentyl)-1,3-thiazol-2-yl]acetamide is Cc1cc(CC(=O)Nc2ncc(C3CCC(=O)C3)s2)on1.
What is the InChIKey of 2-(3-methyl-1,2-oxazol-5-yl)-N-[5-(3-oxocyclopentyl)-1,3-thiazol-2-yl]acetamide?
The InChIKey is JDZXBKFVYYFKHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3S/c1-8-4-11(20-17-8)6-13(19)16-14-15-7-12(21-14)9-2-3-10(18)5-9/h4,7,9H,2-3,5-6H2,1H3,(H,15,16,19).
What are the key properties of 2-(3-methyl-1,2-oxazol-5-yl)-N-[5-(3-oxocyclopentyl)-1,3-thiazol-2-yl]acetamide?
2-(3-methyl-1,2-oxazol-5-yl)-N-[5-(3-oxocyclopentyl)-1,3-thiazol-2-yl]acetamide has a molecular weight of 305.36 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-1,2-oxazol-5-yl)-N-[5-(3-oxocyclopentyl)-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 164880341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).