2-cyclohexyl-4-methyl-5-piperidin-4-yl-1,3-thiazole

C15H24N2S — CID 116885152

IUPAC2-cyclohexyl-4-methyl-5-piperidin-4-yl-1,3-thiazole
SMILESCc1nc(C2CCCCC2)sc1C1CCNCC1
InChIInChI=1S/C15H24N2S/c1-11-14(12-7-9-16-10-8-12)18-15(17-11)13-5-3-2-4-6-13/h12-13,16H,2-10H2,1H3
InChIKeyUBQKNCWPNWUCFN-UHFFFAOYSA-N
MW264.44 g/mol
LogP3.97
Rot. Bonds2

About 2-cyclohexyl-4-methyl-5-piperidin-4-yl-1,3-thiazole

2-cyclohexyl-4-methyl-5-piperidin-4-yl-1,3-thiazole (PubChem CID 116885152) has the molecular formula C15H24N2S and a molecular weight of 264.44 g/mol. Its IUPAC name is 2-cyclohexyl-4-methyl-5-piperidin-4-yl-1,3-thiazole.

Molecular Properties

Compound Name2-cyclohexyl-4-methyl-5-piperidin-4-yl-1,3-thiazole
PubChem CID116885152
Molecular FormulaC15H24N2S
Molecular Weight264.44 g/mol
Exact Mass264.17
IUPAC Name2-cyclohexyl-4-methyl-5-piperidin-4-yl-1,3-thiazole
SMILESCc1nc(C2CCCCC2)sc1C1CCNCC1
InChIInChI=1S/C15H24N2S/c1-11-14(12-7-9-16-10-8-12)18-15(17-11)13-5-3-2-4-6-13/h12-13,16H,2-10H2,1H3
InChIKeyUBQKNCWPNWUCFN-UHFFFAOYSA-N
XLogP3.97
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.44
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopentyl-4-methyl-5-pyrrolidin-3-yl-1,3-thiazole
CID 116885085
4-(2-cyclopentyl-4-methyl-1,3-thiazol-5-yl)cyclohexan-1-amine
CID 116885301
2-cyclobutyl-4-methyl-5-piperidin-3-yl-1,3-thiazole
CID 116885135
2-cyclopentyl-4-methyl-5-piperidin-2-yl-1,3-thiazole
CID 116885109
2-cyclohexyl-4-methyl-5-(pyrrolidin-3-ylmethyl)-1,3-thiazole
CID 116885195
(2-cycloheptyl-4-methyl-1,3-thiazol-5-yl)methanamine
CID 65400000
2-cyclohexyl-5-pyrrolidin-3-yl-1,3,4-thiadiazole
CID 115042250
4-cyclohexyl-2-piperidin-4-yl-1,3-thiazole;hydrochloride
CID 120558204
2-[(2-cyclopentyl-4-methyl-1,3-thiazol-5-yl)methyl]morpholine
CID 116886580
2-cyclobutyl-4-methyl-5-(piperidin-3-ylmethyl)-1,3-thiazole
CID 116885219
4-(4-bromophenyl)-5-methyl-2-piperidin-4-yl-1,3-thiazole;hydrochloride
CID 120558190
1-(2-cyclohexyl-4-methyl-1,3-thiazol-5-yl)cyclopropan-1-amine
CID 116887445

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-4-methyl-5-piperidin-4-yl-1,3-thiazole?
The IUPAC name of 2-cyclohexyl-4-methyl-5-piperidin-4-yl-1,3-thiazole (CID 116885152) is 2-cyclohexyl-4-methyl-5-piperidin-4-yl-1,3-thiazole.
What is the SMILES notation for 2-cyclohexyl-4-methyl-5-piperidin-4-yl-1,3-thiazole?
The canonical SMILES for 2-cyclohexyl-4-methyl-5-piperidin-4-yl-1,3-thiazole is Cc1nc(C2CCCCC2)sc1C1CCNCC1.
What is the InChIKey of 2-cyclohexyl-4-methyl-5-piperidin-4-yl-1,3-thiazole?
The InChIKey is UBQKNCWPNWUCFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2S/c1-11-14(12-7-9-16-10-8-12)18-15(17-11)13-5-3-2-4-6-13/h12-13,16H,2-10H2,1H3.
What are the key properties of 2-cyclohexyl-4-methyl-5-piperidin-4-yl-1,3-thiazole?
2-cyclohexyl-4-methyl-5-piperidin-4-yl-1,3-thiazole has a molecular weight of 264.44 g/mol, XLogP of 3.97, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-4-methyl-5-piperidin-4-yl-1,3-thiazole is sourced from PubChem (CID 116885152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).