N-(4-cyclohexyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide

C14H22N2OS — CID 58563900

IUPACN-(4-cyclohexyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1nc(C2CCCCC2)cs1
InChIInChI=1S/C14H22N2OS/c1-14(2,3)12(17)16-13-15-11(9-18-13)10-7-5-4-6-8-10/h9-10H,4-8H2,1-3H3,(H,15,16,17)
InChIKeyZOMKNTKQMIVLKD-UHFFFAOYSA-N
MW266.41 g/mol
LogP4.18
Rot. Bonds2

About N-(4-cyclohexyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide

N-(4-cyclohexyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide (PubChem CID 58563900) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is N-(4-cyclohexyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(4-cyclohexyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide
PubChem CID58563900
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC NameN-(4-cyclohexyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1nc(C2CCCCC2)cs1
InChIInChI=1S/C14H22N2OS/c1-14(2,3)12(17)16-13-15-11(9-18-13)10-7-5-4-6-8-10/h9-10H,4-8H2,1-3H3,(H,15,16,17)
InChIKeyZOMKNTKQMIVLKD-UHFFFAOYSA-N
XLogP4.18
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-cyclohexyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide?
The IUPAC name of N-(4-cyclohexyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide (CID 58563900) is N-(4-cyclohexyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(4-cyclohexyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(4-cyclohexyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide is CC(C)(C)C(=O)Nc1nc(C2CCCCC2)cs1.
What is the InChIKey of N-(4-cyclohexyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide?
The InChIKey is ZOMKNTKQMIVLKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-14(2,3)12(17)16-13-15-11(9-18-13)10-7-5-4-6-8-10/h9-10H,4-8H2,1-3H3,(H,15,16,17).
What are the key properties of N-(4-cyclohexyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide?
N-(4-cyclohexyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide has a molecular weight of 266.41 g/mol, XLogP of 4.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyclohexyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide is sourced from PubChem (CID 58563900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).