1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-thiazol-5-yl]ethanol

C15H17NOS — CID 63250668

IUPAC1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-thiazol-5-yl]ethanol
SMILESCC(O)c1cnc(C2CCCc3ccccc32)s1
InChIInChI=1S/C15H17NOS/c1-10(17)14-9-16-15(18-14)13-8-4-6-11-5-2-3-7-12(11)13/h2-3,5,7,9-10,13,17H,4,6,8H2,1H3
InChIKeyMUOVPTGRVNGLTA-UHFFFAOYSA-N
MW259.37 g/mol
LogP3.66
Rot. Bonds2

About 1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-thiazol-5-yl]ethanol

1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-thiazol-5-yl]ethanol (PubChem CID 63250668) has the molecular formula C15H17NOS and a molecular weight of 259.37 g/mol. Its IUPAC name is 1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-thiazol-5-yl]ethanol.

Molecular Properties

Compound Name1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-thiazol-5-yl]ethanol
PubChem CID63250668
Molecular FormulaC15H17NOS
Molecular Weight259.37 g/mol
Exact Mass259.10
IUPAC Name1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-thiazol-5-yl]ethanol
SMILESCC(O)c1cnc(C2CCCc3ccccc32)s1
InChIInChI=1S/C15H17NOS/c1-10(17)14-9-16-15(18-14)13-8-4-6-11-5-2-3-7-12(11)13/h2-3,5,7,9-10,13,17H,4,6,8H2,1H3
InChIKeyMUOVPTGRVNGLTA-UHFFFAOYSA-N
XLogP3.66
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.37
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-thiazol-5-yl]ethanamine
CID 63250996
1-[2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1,3-thiazol-5-yl]ethanamine
CID 64984326
1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol
CID 63247593
[4-(2-methylpropyl)-2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-thiazol-5-yl]methanamine
CID 114362069
1-(2-piperidin-4-yl-1,3-thiazol-5-yl)ethanol
CID 115089882
2-(1,2,3,4-tetrahydronaphthalen-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazol-7-ol
CID 63250667
1-[2-(1,1-dioxothian-3-yl)-1,3-thiazol-5-yl]ethanol
CID 115090326
N-[[2-(2,3-dihydro-1H-inden-1-yl)-1,3-thiazol-5-yl]methyl]-2-methylpropan-2-amine
CID 65405624
1-(2-methylpropyl)-1,2,3,4-tetrahydronaphthalene
CID 54453127
4-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]phenol
CID 93476534
1-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene
CID 159713815
1-[2-(2,3-dihydroindol-1-yl)-1,3-thiazol-5-yl]ethanol
CID 62752443

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-thiazol-5-yl]ethanol?
The IUPAC name of 1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-thiazol-5-yl]ethanol (CID 63250668) is 1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-thiazol-5-yl]ethanol.
What is the SMILES notation for 1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-thiazol-5-yl]ethanol?
The canonical SMILES for 1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-thiazol-5-yl]ethanol is CC(O)c1cnc(C2CCCc3ccccc32)s1.
What is the InChIKey of 1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-thiazol-5-yl]ethanol?
The InChIKey is MUOVPTGRVNGLTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NOS/c1-10(17)14-9-16-15(18-14)13-8-4-6-11-5-2-3-7-12(11)13/h2-3,5,7,9-10,13,17H,4,6,8H2,1H3.
What are the key properties of 1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-thiazol-5-yl]ethanol?
1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-thiazol-5-yl]ethanol has a molecular weight of 259.37 g/mol, XLogP of 3.66, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-thiazol-5-yl]ethanol is sourced from PubChem (CID 63250668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).