3-cyclopropyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-ol

C12H16N2OS — CID 115828299

IUPAC3-cyclopropyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-ol
SMILESCC(C(O)Cc1cn2ccsc2n1)C1CC1
InChIInChI=1S/C12H16N2OS/c1-8(9-2-3-9)11(15)6-10-7-14-4-5-16-12(14)13-10/h4-5,7-9,11,15H,2-3,6H2,1H3
InChIKeyHCXSFGOHONAMAP-UHFFFAOYSA-N
MW236.34 g/mol
LogP2.35
Rot. Bonds4

About 3-cyclopropyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-ol

3-cyclopropyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-ol (PubChem CID 115828299) has the molecular formula C12H16N2OS and a molecular weight of 236.34 g/mol. Its IUPAC name is 3-cyclopropyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-ol.

Molecular Properties

Compound Name3-cyclopropyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-ol
PubChem CID115828299
Molecular FormulaC12H16N2OS
Molecular Weight236.34 g/mol
Exact Mass236.10
IUPAC Name3-cyclopropyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-ol
SMILESCC(C(O)Cc1cn2ccsc2n1)C1CC1
InChIInChI=1S/C12H16N2OS/c1-8(9-2-3-9)11(15)6-10-7-14-4-5-16-12(14)13-10/h4-5,7-9,11,15H,2-3,6H2,1H3
InChIKeyHCXSFGOHONAMAP-UHFFFAOYSA-N
XLogP2.35
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-cycloheptyl-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol
CID 115332915
3-cyclopropyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-one
CID 115792010
1-(cyclopropylamino)-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-ol
CID 115335079
1-(4-butylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol
CID 115828251
6-(3-bromo-2-methylpropyl)imidazo[2,1-b][1,3]thiazole
CID 115335190
N-(2-cyclopentyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropyl)-2-methylpropan-1-amine
CID 115926891
1-imidazo[2,1-b][1,3]thiazol-6-yl-3-propan-2-ylsulfanylpropan-2-ol
CID 115333283
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-1-(oxan-4-yl)ethanamine
CID 115333735
1-imidazo[2,1-b][1,3]thiazol-6-yl-3-methylsulfanylpropan-2-ol
CID 115333257
1-(3,5-dimethylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol
CID 115332851
N-[2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-4-methylpentyl]cyclopropanamine
CID 115334270
1-(dimethylamino)-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-ol
CID 115333340

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-ol?
The IUPAC name of 3-cyclopropyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-ol (CID 115828299) is 3-cyclopropyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-ol.
What is the SMILES notation for 3-cyclopropyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-ol?
The canonical SMILES for 3-cyclopropyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-ol is CC(C(O)Cc1cn2ccsc2n1)C1CC1.
What is the InChIKey of 3-cyclopropyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-ol?
The InChIKey is HCXSFGOHONAMAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2OS/c1-8(9-2-3-9)11(15)6-10-7-14-4-5-16-12(14)13-10/h4-5,7-9,11,15H,2-3,6H2,1H3.
What are the key properties of 3-cyclopropyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-ol?
3-cyclopropyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-ol has a molecular weight of 236.34 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-ol is sourced from PubChem (CID 115828299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).