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

C14H17NOS — CID 94267224

IUPAC2-[4-(4-propylphenyl)-1,3-thiazol-2-yl]ethanol
SMILESCCCc1ccc(-c2csc(CCO)n2)cc1
InChIInChI=1S/C14H17NOS/c1-2-3-11-4-6-12(7-5-11)13-10-17-14(15-13)8-9-16/h4-7,10,16H,2-3,8-9H2,1H3
InChIKeyFRQCKLFRCHHLDF-UHFFFAOYSA-N
MW247.36 g/mol
LogP3.30
Rot. Bonds5

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

2-[4-(4-propylphenyl)-1,3-thiazol-2-yl]ethanol (PubChem CID 94267224) has the molecular formula C14H17NOS and a molecular weight of 247.36 g/mol. Its IUPAC name is 2-[4-(4-propylphenyl)-1,3-thiazol-2-yl]ethanol.

Molecular Properties

Compound Name2-[4-(4-propylphenyl)-1,3-thiazol-2-yl]ethanol
PubChem CID94267224
Molecular FormulaC14H17NOS
Molecular Weight247.36 g/mol
Exact Mass247.10
IUPAC Name2-[4-(4-propylphenyl)-1,3-thiazol-2-yl]ethanol
SMILESCCCc1ccc(-c2csc(CCO)n2)cc1
InChIInChI=1S/C14H17NOS/c1-2-3-11-4-6-12(7-5-11)13-10-17-14(15-13)8-9-16/h4-7,10,16H,2-3,8-9H2,1H3
InChIKeyFRQCKLFRCHHLDF-UHFFFAOYSA-N
XLogP3.30
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.36
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(chloromethyl)-4-(4-propylphenyl)-1,3-thiazole
CID 62923597
N-methyl-2-[4-(4-propylphenyl)-1,3-thiazol-2-yl]ethanamine;hydrochloride
CID 120558492
2-[4-[2-(aminomethyl)-1,3-thiazol-4-yl]phenyl]ethanol
CID 177213741
2-[4-(4-ethylsulfanylphenyl)-1,3-thiazol-2-yl]ethanol
CID 116867767
4-[4-(4-propylphenyl)-1,3-thiazol-2-yl]aniline
CID 43667849
N-benzyl-2-[4-(4-propylphenyl)-1,3-thiazol-2-yl]acetamide
CID 9233048
2-[4-(4-butylphenyl)-1,3-thiazol-2-yl]acetonitrile
CID 95464853
N-(2-methylphenyl)-2-[4-(4-propylphenyl)-1,3-thiazol-2-yl]acetamide
CID 8963536
4-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]butan-2-amine
CID 116965129
1-[4-(4-propylphenyl)-1,3-thiazol-2-yl]cyclopropan-1-amine
CID 116967625
5-[2-(2-hydroxyethyl)-1,3-thiazol-4-yl]-1,3-dihydrobenzimidazol-2-one
CID 116867771
N'-[2-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]ethyl]ethane-1,2-diamine
CID 82102821

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-propylphenyl)-1,3-thiazol-2-yl]ethanol?
The IUPAC name of 2-[4-(4-propylphenyl)-1,3-thiazol-2-yl]ethanol (CID 94267224) is 2-[4-(4-propylphenyl)-1,3-thiazol-2-yl]ethanol.
What is the SMILES notation for 2-[4-(4-propylphenyl)-1,3-thiazol-2-yl]ethanol?
The canonical SMILES for 2-[4-(4-propylphenyl)-1,3-thiazol-2-yl]ethanol is CCCc1ccc(-c2csc(CCO)n2)cc1.
What is the InChIKey of 2-[4-(4-propylphenyl)-1,3-thiazol-2-yl]ethanol?
The InChIKey is FRQCKLFRCHHLDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NOS/c1-2-3-11-4-6-12(7-5-11)13-10-17-14(15-13)8-9-16/h4-7,10,16H,2-3,8-9H2,1H3.
What are the key properties of 2-[4-(4-propylphenyl)-1,3-thiazol-2-yl]ethanol?
2-[4-(4-propylphenyl)-1,3-thiazol-2-yl]ethanol has a molecular weight of 247.36 g/mol, XLogP of 3.30, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-propylphenyl)-1,3-thiazol-2-yl]ethanol is sourced from PubChem (CID 94267224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).