2-(5-cyclohexyl-1,3-thiazol-2-yl)-1-methylcyclobutane-1-carboxamide

C15H22N2OS — CID 155622164

IUPAC2-(5-cyclohexyl-1,3-thiazol-2-yl)-1-methylcyclobutane-1-carboxamide
SMILESCC1(C(N)=O)CCC1c1ncc(C2CCCCC2)s1
InChIInChI=1S/C15H22N2OS/c1-15(14(16)18)8-7-11(15)13-17-9-12(19-13)10-5-3-2-4-6-10/h9-11H,2-8H2,1H3,(H2,16,18)
InChIKeyZSEGXBHYROCOQS-UHFFFAOYSA-N
MW278.42 g/mol
LogP3.56
Rot. Bonds3

About 2-(5-cyclohexyl-1,3-thiazol-2-yl)-1-methylcyclobutane-1-carboxamide

2-(5-cyclohexyl-1,3-thiazol-2-yl)-1-methylcyclobutane-1-carboxamide (PubChem CID 155622164) has the molecular formula C15H22N2OS and a molecular weight of 278.42 g/mol. Its IUPAC name is 2-(5-cyclohexyl-1,3-thiazol-2-yl)-1-methylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name2-(5-cyclohexyl-1,3-thiazol-2-yl)-1-methylcyclobutane-1-carboxamide
PubChem CID155622164
Molecular FormulaC15H22N2OS
Molecular Weight278.42 g/mol
Exact Mass278.15
IUPAC Name2-(5-cyclohexyl-1,3-thiazol-2-yl)-1-methylcyclobutane-1-carboxamide
SMILESCC1(C(N)=O)CCC1c1ncc(C2CCCCC2)s1
InChIInChI=1S/C15H22N2OS/c1-15(14(16)18)8-7-11(15)13-17-9-12(19-13)10-5-3-2-4-6-10/h9-11H,2-8H2,1H3,(H2,16,18)
InChIKeyZSEGXBHYROCOQS-UHFFFAOYSA-N
XLogP3.56
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.42
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5-cyclohexyl-1,3-thiazol-2-yl)-1-methylcyclobutane-1-carboxamide?
The IUPAC name of 2-(5-cyclohexyl-1,3-thiazol-2-yl)-1-methylcyclobutane-1-carboxamide (CID 155622164) is 2-(5-cyclohexyl-1,3-thiazol-2-yl)-1-methylcyclobutane-1-carboxamide.
What is the SMILES notation for 2-(5-cyclohexyl-1,3-thiazol-2-yl)-1-methylcyclobutane-1-carboxamide?
The canonical SMILES for 2-(5-cyclohexyl-1,3-thiazol-2-yl)-1-methylcyclobutane-1-carboxamide is CC1(C(N)=O)CCC1c1ncc(C2CCCCC2)s1.
What is the InChIKey of 2-(5-cyclohexyl-1,3-thiazol-2-yl)-1-methylcyclobutane-1-carboxamide?
The InChIKey is ZSEGXBHYROCOQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2OS/c1-15(14(16)18)8-7-11(15)13-17-9-12(19-13)10-5-3-2-4-6-10/h9-11H,2-8H2,1H3,(H2,16,18).
What are the key properties of 2-(5-cyclohexyl-1,3-thiazol-2-yl)-1-methylcyclobutane-1-carboxamide?
2-(5-cyclohexyl-1,3-thiazol-2-yl)-1-methylcyclobutane-1-carboxamide has a molecular weight of 278.42 g/mol, XLogP of 3.56, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-cyclohexyl-1,3-thiazol-2-yl)-1-methylcyclobutane-1-carboxamide is sourced from PubChem (CID 155622164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).