N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclopentylacetamide

C14H22N2OS — CID 166626463

IUPACN-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclopentylacetamide
SMILESCC(C)(C)c1csc(NC(=O)CC2CCCC2)n1
InChIInChI=1S/C14H22N2OS/c1-14(2,3)11-9-18-13(15-11)16-12(17)8-10-6-4-5-7-10/h9-10H,4-8H2,1-3H3,(H,15,16,17)
InChIKeyVCFGOILLLVMFEI-UHFFFAOYSA-N
MW266.41 g/mol
LogP3.96
Rot. Bonds3

About N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclopentylacetamide

N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclopentylacetamide (PubChem CID 166626463) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclopentylacetamide.

Molecular Properties

Compound NameN-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclopentylacetamide
PubChem CID166626463
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC NameN-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclopentylacetamide
SMILESCC(C)(C)c1csc(NC(=O)CC2CCCC2)n1
InChIInChI=1S/C14H22N2OS/c1-14(2,3)11-9-18-13(15-11)16-12(17)8-10-6-4-5-7-10/h9-10H,4-8H2,1-3H3,(H,15,16,17)
InChIKeyVCFGOILLLVMFEI-UHFFFAOYSA-N
XLogP3.96
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclopentylacetamide?
The IUPAC name of N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclopentylacetamide (CID 166626463) is N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclopentylacetamide.
What is the SMILES notation for N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclopentylacetamide?
The canonical SMILES for N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclopentylacetamide is CC(C)(C)c1csc(NC(=O)CC2CCCC2)n1.
What is the InChIKey of N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclopentylacetamide?
The InChIKey is VCFGOILLLVMFEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-14(2,3)11-9-18-13(15-11)16-12(17)8-10-6-4-5-7-10/h9-10H,4-8H2,1-3H3,(H,15,16,17).
What are the key properties of N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclopentylacetamide?
N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclopentylacetamide has a molecular weight of 266.41 g/mol, XLogP of 3.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclopentylacetamide is sourced from PubChem (CID 166626463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).