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

C15H24N2O2S — CID 166627625

IUPACN-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclohexyloxyacetamide
SMILESCC(C)(C)c1csc(NC(=O)COC2CCCCC2)n1
InChIInChI=1S/C15H24N2O2S/c1-15(2,3)12-10-20-14(16-12)17-13(18)9-19-11-7-5-4-6-8-11/h10-11H,4-9H2,1-3H3,(H,16,17,18)
InChIKeyLAQGNPXBVAQPSH-UHFFFAOYSA-N
MW296.44 g/mol
LogP3.73
Rot. Bonds4

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

N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclohexyloxyacetamide (PubChem CID 166627625) has the molecular formula C15H24N2O2S and a molecular weight of 296.44 g/mol. Its IUPAC name is N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclohexyloxyacetamide.

Molecular Properties

Compound NameN-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclohexyloxyacetamide
PubChem CID166627625
Molecular FormulaC15H24N2O2S
Molecular Weight296.44 g/mol
Exact Mass296.16
IUPAC NameN-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclohexyloxyacetamide
SMILESCC(C)(C)c1csc(NC(=O)COC2CCCCC2)n1
InChIInChI=1S/C15H24N2O2S/c1-15(2,3)12-10-20-14(16-12)17-13(18)9-19-11-7-5-4-6-8-11/h10-11H,4-9H2,1-3H3,(H,16,17,18)
InChIKeyLAQGNPXBVAQPSH-UHFFFAOYSA-N
XLogP3.73
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclohexyloxyacetamide?
The IUPAC name of N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclohexyloxyacetamide (CID 166627625) is N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclohexyloxyacetamide.
What is the SMILES notation for N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclohexyloxyacetamide?
The canonical SMILES for N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclohexyloxyacetamide is CC(C)(C)c1csc(NC(=O)COC2CCCCC2)n1.
What is the InChIKey of N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclohexyloxyacetamide?
The InChIKey is LAQGNPXBVAQPSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2S/c1-15(2,3)12-10-20-14(16-12)17-13(18)9-19-11-7-5-4-6-8-11/h10-11H,4-9H2,1-3H3,(H,16,17,18).
What are the key properties of N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclohexyloxyacetamide?
N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclohexyloxyacetamide has a molecular weight of 296.44 g/mol, XLogP of 3.73, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-tert-butyl-1,3-thiazol-2-yl)-2-cyclohexyloxyacetamide is sourced from PubChem (CID 166627625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).