4-(2-methoxyphenyl)-2-piperidin-4-yl-1,3-thiazole

C15H18N2OS — CID 62542320

IUPAC4-(2-methoxyphenyl)-2-piperidin-4-yl-1,3-thiazole
SMILESCOc1ccccc1-c1csc(C2CCNCC2)n1
InChIInChI=1S/C15H18N2OS/c1-18-14-5-3-2-4-12(14)13-10-19-15(17-13)11-6-8-16-9-7-11/h2-5,10-11,16H,6-9H2,1H3
InChIKeyOWRIBNXERSFIDU-UHFFFAOYSA-N
MW274.39 g/mol
LogP3.29
Rot. Bonds3

About 4-(2-methoxyphenyl)-2-piperidin-4-yl-1,3-thiazole

4-(2-methoxyphenyl)-2-piperidin-4-yl-1,3-thiazole (PubChem CID 62542320) has the molecular formula C15H18N2OS and a molecular weight of 274.39 g/mol. Its IUPAC name is 4-(2-methoxyphenyl)-2-piperidin-4-yl-1,3-thiazole.

Molecular Properties

Compound Name4-(2-methoxyphenyl)-2-piperidin-4-yl-1,3-thiazole
PubChem CID62542320
Molecular FormulaC15H18N2OS
Molecular Weight274.39 g/mol
Exact Mass274.11
IUPAC Name4-(2-methoxyphenyl)-2-piperidin-4-yl-1,3-thiazole
SMILESCOc1ccccc1-c1csc(C2CCNCC2)n1
InChIInChI=1S/C15H18N2OS/c1-18-14-5-3-2-4-12(14)13-10-19-15(17-13)11-6-8-16-9-7-11/h2-5,10-11,16H,6-9H2,1H3
InChIKeyOWRIBNXERSFIDU-UHFFFAOYSA-N
XLogP3.29
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyphenyl)-2-piperidin-4-yl-1,3-thiazole?
The IUPAC name of 4-(2-methoxyphenyl)-2-piperidin-4-yl-1,3-thiazole (CID 62542320) is 4-(2-methoxyphenyl)-2-piperidin-4-yl-1,3-thiazole.
What is the SMILES notation for 4-(2-methoxyphenyl)-2-piperidin-4-yl-1,3-thiazole?
The canonical SMILES for 4-(2-methoxyphenyl)-2-piperidin-4-yl-1,3-thiazole is COc1ccccc1-c1csc(C2CCNCC2)n1.
What is the InChIKey of 4-(2-methoxyphenyl)-2-piperidin-4-yl-1,3-thiazole?
The InChIKey is OWRIBNXERSFIDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2OS/c1-18-14-5-3-2-4-12(14)13-10-19-15(17-13)11-6-8-16-9-7-11/h2-5,10-11,16H,6-9H2,1H3.
What are the key properties of 4-(2-methoxyphenyl)-2-piperidin-4-yl-1,3-thiazole?
4-(2-methoxyphenyl)-2-piperidin-4-yl-1,3-thiazole has a molecular weight of 274.39 g/mol, XLogP of 3.29, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyphenyl)-2-piperidin-4-yl-1,3-thiazole is sourced from PubChem (CID 62542320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).