2,4-di(cyclobutyl)-1,3-thiazole

C11H15NS — CID 130688661

IUPAC2,4-di(cyclobutyl)-1,3-thiazole
SMILESc1sc(C2CCC2)nc1C1CCC1
InChIInChI=1S/C11H15NS/c1-3-8(4-1)10-7-13-11(12-10)9-5-2-6-9/h7-9H,1-6H2
InChIKeyUYTYORGVWONERD-UHFFFAOYSA-N
MW193.31 g/mol
LogP3.68
Rot. Bonds2

About 2,4-di(cyclobutyl)-1,3-thiazole

2,4-di(cyclobutyl)-1,3-thiazole (PubChem CID 130688661) has the molecular formula C11H15NS and a molecular weight of 193.31 g/mol. Its IUPAC name is 2,4-di(cyclobutyl)-1,3-thiazole.

Molecular Properties

Compound Name2,4-di(cyclobutyl)-1,3-thiazole
PubChem CID130688661
Molecular FormulaC11H15NS
Molecular Weight193.31 g/mol
Exact Mass193.09
IUPAC Name2,4-di(cyclobutyl)-1,3-thiazole
SMILESc1sc(C2CCC2)nc1C1CCC1
InChIInChI=1S/C11H15NS/c1-3-8(4-1)10-7-13-11(12-10)9-5-2-6-9/h7-9H,1-6H2
InChIKeyUYTYORGVWONERD-UHFFFAOYSA-N
XLogP3.68
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.31
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-cyclohexyl-2-piperidin-4-yl-1,3-thiazole;hydrochloride
CID 120558204
4-(2-cyclohexyl-1,3-thiazol-4-yl)cyclohexan-1-ol
CID 116890500
4-(4-cyclohexyl-1,3-thiazol-2-yl)cyclohexan-1-amine
CID 116965467
4-(4-cyclopentyl-1,3-thiazol-2-yl)-N-methylcyclohexan-1-amine
CID 116965480
4-cyclopentyl-2-piperidin-2-yl-1,3-thiazole
CID 62634064
4-(oxan-4-yl)-2-piperidin-4-yl-1,3-thiazole
CID 116965399
4-cyclobutyl-2-propan-2-yl-1,3-thiazole
CID 126992198
4-(1-methylpiperidin-3-yl)-2-piperidin-4-yl-1,3-thiazole
CID 116965401
2-(azetidin-3-yl)-4-(thian-3-yl)-1,3-thiazole
CID 115043922
4-cyclobutyl-1,3-thiazole-2-carboxylic acid
CID 86646410
2,4-di(pyrrolidin-3-yl)-1,3-thiazole
CID 115034162
2-[5-(2-cyclobutyl-1,3-thiazol-4-yl)thiophen-2-yl]acetic acid
CID 64982442

Frequently Asked Questions

What is the IUPAC name of 2,4-di(cyclobutyl)-1,3-thiazole?
The IUPAC name of 2,4-di(cyclobutyl)-1,3-thiazole (CID 130688661) is 2,4-di(cyclobutyl)-1,3-thiazole.
What is the SMILES notation for 2,4-di(cyclobutyl)-1,3-thiazole?
The canonical SMILES for 2,4-di(cyclobutyl)-1,3-thiazole is c1sc(C2CCC2)nc1C1CCC1.
What is the InChIKey of 2,4-di(cyclobutyl)-1,3-thiazole?
The InChIKey is UYTYORGVWONERD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NS/c1-3-8(4-1)10-7-13-11(12-10)9-5-2-6-9/h7-9H,1-6H2.
What are the key properties of 2,4-di(cyclobutyl)-1,3-thiazole?
2,4-di(cyclobutyl)-1,3-thiazole has a molecular weight of 193.31 g/mol, XLogP of 3.68, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-di(cyclobutyl)-1,3-thiazole is sourced from PubChem (CID 130688661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).