2-(4-phenyl-1,3-thiazol-2-yl)-1-piperidin-3-ylethanol

C16H20N2OS — CID 80559303

IUPAC2-(4-phenyl-1,3-thiazol-2-yl)-1-piperidin-3-ylethanol
SMILESOC(Cc1nc(-c2ccccc2)cs1)C1CCCNC1
InChIInChI=1S/C16H20N2OS/c19-15(13-7-4-8-17-10-13)9-16-18-14(11-20-16)12-5-2-1-3-6-12/h1-3,5-6,11,13,15,17,19H,4,7-10H2
InChIKeyMVWDTTVQVKWUOU-UHFFFAOYSA-N
MW288.42 g/mol
LogP2.71
Rot. Bonds4

About 2-(4-phenyl-1,3-thiazol-2-yl)-1-piperidin-3-ylethanol

2-(4-phenyl-1,3-thiazol-2-yl)-1-piperidin-3-ylethanol (PubChem CID 80559303) has the molecular formula C16H20N2OS and a molecular weight of 288.42 g/mol. Its IUPAC name is 2-(4-phenyl-1,3-thiazol-2-yl)-1-piperidin-3-ylethanol.

Molecular Properties

Compound Name2-(4-phenyl-1,3-thiazol-2-yl)-1-piperidin-3-ylethanol
PubChem CID80559303
Molecular FormulaC16H20N2OS
Molecular Weight288.42 g/mol
Exact Mass288.13
IUPAC Name2-(4-phenyl-1,3-thiazol-2-yl)-1-piperidin-3-ylethanol
SMILESOC(Cc1nc(-c2ccccc2)cs1)C1CCCNC1
InChIInChI=1S/C16H20N2OS/c19-15(13-7-4-8-17-10-13)9-16-18-14(11-20-16)12-5-2-1-3-6-12/h1-3,5-6,11,13,15,17,19H,4,7-10H2
InChIKeyMVWDTTVQVKWUOU-UHFFFAOYSA-N
XLogP2.71
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.42
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclopropyl-2-(4-phenyl-1,3-thiazol-2-yl)ethanol
CID 79819550
1-(6-bicyclo[3.1.0]hexanyl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol
CID 115817879
1-(2-methylcyclopentyl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol
CID 107192609
1-cyclopentyl-3-(4-phenyl-1,3-thiazol-2-yl)propan-2-ol
CID 115817937
N-(4-phenyl-1,3-thiazol-2-yl)-3-piperidin-3-ylbutanamide;hydrochloride
CID 119670223
1-(3-methyl-1,4-dithian-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol
CID 115386153
1-piperidin-3-yl-2-pyridin-2-ylethanol
CID 80560318
2-fluoro-3-(4-phenyl-1,3-thiazol-2-yl)propanoic acid
CID 79817950
4-methyl-1-(4-phenyl-1,3-thiazol-2-yl)pentane-2,3-diol
CID 103456577
triphenyl-[(4-phenyl-1,3-thiazol-2-yl)methyl]phosphanium
CID 23143294
1-(3-bicyclo[3.1.0]hexanyl)-N-methyl-2-(4-phenyl-1,3-thiazol-2-yl)ethanamine
CID 105006662
1-cyclopentylsulfanyl-3-(4-phenyl-1,3-thiazol-2-yl)propan-2-amine
CID 79825749

Frequently Asked Questions

What is the IUPAC name of 2-(4-phenyl-1,3-thiazol-2-yl)-1-piperidin-3-ylethanol?
The IUPAC name of 2-(4-phenyl-1,3-thiazol-2-yl)-1-piperidin-3-ylethanol (CID 80559303) is 2-(4-phenyl-1,3-thiazol-2-yl)-1-piperidin-3-ylethanol.
What is the SMILES notation for 2-(4-phenyl-1,3-thiazol-2-yl)-1-piperidin-3-ylethanol?
The canonical SMILES for 2-(4-phenyl-1,3-thiazol-2-yl)-1-piperidin-3-ylethanol is OC(Cc1nc(-c2ccccc2)cs1)C1CCCNC1.
What is the InChIKey of 2-(4-phenyl-1,3-thiazol-2-yl)-1-piperidin-3-ylethanol?
The InChIKey is MVWDTTVQVKWUOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2OS/c19-15(13-7-4-8-17-10-13)9-16-18-14(11-20-16)12-5-2-1-3-6-12/h1-3,5-6,11,13,15,17,19H,4,7-10H2.
What are the key properties of 2-(4-phenyl-1,3-thiazol-2-yl)-1-piperidin-3-ylethanol?
2-(4-phenyl-1,3-thiazol-2-yl)-1-piperidin-3-ylethanol has a molecular weight of 288.42 g/mol, XLogP of 2.71, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenyl-1,3-thiazol-2-yl)-1-piperidin-3-ylethanol is sourced from PubChem (CID 80559303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).