[6-(4-ethyl-4-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol

C14H21N3OS — CID 63158682

IUPAC[6-(4-ethyl-4-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol
SMILESCCC1(C)CCN(c2nc3sccn3c2CO)CC1
InChIInChI=1S/C14H21N3OS/c1-3-14(2)4-6-16(7-5-14)12-11(10-18)17-8-9-19-13(17)15-12/h8-9,18H,3-7,10H2,1-2H3
InChIKeyPPCHROYMSYRXSW-UHFFFAOYSA-N
MW279.41 g/mol
LogP2.90
Rot. Bonds3

About [6-(4-ethyl-4-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol

[6-(4-ethyl-4-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol (PubChem CID 63158682) has the molecular formula C14H21N3OS and a molecular weight of 279.41 g/mol. Its IUPAC name is [6-(4-ethyl-4-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol.

Molecular Properties

Compound Name[6-(4-ethyl-4-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol
PubChem CID63158682
Molecular FormulaC14H21N3OS
Molecular Weight279.41 g/mol
Exact Mass279.14
IUPAC Name[6-(4-ethyl-4-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol
SMILESCCC1(C)CCN(c2nc3sccn3c2CO)CC1
InChIInChI=1S/C14H21N3OS/c1-3-14(2)4-6-16(7-5-14)12-11(10-18)17-8-9-19-13(17)15-12/h8-9,18H,3-7,10H2,1-2H3
InChIKeyPPCHROYMSYRXSW-UHFFFAOYSA-N
XLogP2.90
TPSA40.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.41
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [6-(4-ethyl-4-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol?
The IUPAC name of [6-(4-ethyl-4-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol (CID 63158682) is [6-(4-ethyl-4-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol.
What is the SMILES notation for [6-(4-ethyl-4-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol?
The canonical SMILES for [6-(4-ethyl-4-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol is CCC1(C)CCN(c2nc3sccn3c2CO)CC1.
What is the InChIKey of [6-(4-ethyl-4-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol?
The InChIKey is PPCHROYMSYRXSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3OS/c1-3-14(2)4-6-16(7-5-14)12-11(10-18)17-8-9-19-13(17)15-12/h8-9,18H,3-7,10H2,1-2H3.
What are the key properties of [6-(4-ethyl-4-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol?
[6-(4-ethyl-4-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol has a molecular weight of 279.41 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(4-ethyl-4-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol is sourced from PubChem (CID 63158682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).