[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone

C19H20ClN3O2S — CID 45172039

IUPAC[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone
SMILESO=C(c1csc2nc(-c3ccc(Cl)cc3)cn12)N1CCCCC1CCO
InChIInChI=1S/C19H20ClN3O2S/c20-14-6-4-13(5-7-14)16-11-23-17(12-26-19(23)21-16)18(25)22-9-2-1-3-15(22)8-10-24/h4-7,11-12,15,24H,1-3,8-10H2
InChIKeyDWHOGUCOWMRSOD-UHFFFAOYSA-N
MW389.91 g/mol
LogP4.09
Rot. Bonds4

About [6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone

[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone (PubChem CID 45172039) has the molecular formula C19H20ClN3O2S and a molecular weight of 389.91 g/mol. Its IUPAC name is [6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone
PubChem CID45172039
Molecular FormulaC19H20ClN3O2S
Molecular Weight389.91 g/mol
Exact Mass389.10
IUPAC Name[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone
SMILESO=C(c1csc2nc(-c3ccc(Cl)cc3)cn12)N1CCCCC1CCO
InChIInChI=1S/C19H20ClN3O2S/c20-14-6-4-13(5-7-14)16-11-23-17(12-26-19(23)21-16)18(25)22-9-2-1-3-15(22)8-10-24/h4-7,11-12,15,24H,1-3,8-10H2
InChIKeyDWHOGUCOWMRSOD-UHFFFAOYSA-N
XLogP4.09
TPSA57.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.91
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazole-3-carboxylic acid
CID 25219646
[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-[4-(methoxymethyl)piperidin-1-yl]methanone
CID 119073846
[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-[(3S)-3-(methoxymethyl)piperidin-1-yl]methanone
CID 42197445
6-(4-chlorophenyl)-N-(oxan-2-ylmethyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 45212982
2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-1-pyrrolidin-1-ylethanone
CID 7522263
[6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-pyrrolidin-1-ylmethanone
CID 42271654
(2,6-dichloro-3-pyridinyl)-[2-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 106993205
6-(4-chlorophenyl)-N-[2-[(3R)-oxolan-3-yl]ethyl]imidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 95199757
[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-6-yl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 72914202
6-(4-chlorophenyl)-N-[(1-hydroxycyclohexyl)methyl]imidazo[2,1-b][1,3]thiazole-3-carboxamide
CID 42520390
(2R)-N-(4-chlorophenyl)-2-(2-hydroxyethyl)piperidine-1-carboxamide
CID 40622393
[2-(aminomethyl)-1,3-thiazol-4-yl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 66378378

Frequently Asked Questions

What is the IUPAC name of [6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone?
The IUPAC name of [6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone (CID 45172039) is [6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone.
What is the SMILES notation for [6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone?
The canonical SMILES for [6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone is O=C(c1csc2nc(-c3ccc(Cl)cc3)cn12)N1CCCCC1CCO.
What is the InChIKey of [6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone?
The InChIKey is DWHOGUCOWMRSOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClN3O2S/c20-14-6-4-13(5-7-14)16-11-23-17(12-26-19(23)21-16)18(25)22-9-2-1-3-15(22)8-10-24/h4-7,11-12,15,24H,1-3,8-10H2.
What are the key properties of [6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone?
[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone has a molecular weight of 389.91 g/mol, XLogP of 4.09, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone is sourced from PubChem (CID 45172039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).