(2-phenyl-4,5-dihydro-1,3-thiazol-4-yl)methanol

C10H11NOS — CID 14617414

IUPAC(2-phenyl-4,5-dihydro-1,3-thiazol-4-yl)methanol
SMILESOCC1CSC(c2ccccc2)=N1
InChIInChI=1S/C10H11NOS/c12-6-9-7-13-10(11-9)8-4-2-1-3-5-8/h1-5,9,12H,6-7H2
InChIKeyHYKRINDPYGQNSQ-UHFFFAOYSA-N
MW193.27 g/mol
LogP1.54
Rot. Bonds2

About (2-phenyl-4,5-dihydro-1,3-thiazol-4-yl)methanol

(2-phenyl-4,5-dihydro-1,3-thiazol-4-yl)methanol (PubChem CID 14617414) has the molecular formula C10H11NOS and a molecular weight of 193.27 g/mol. Its IUPAC name is (2-phenyl-4,5-dihydro-1,3-thiazol-4-yl)methanol.

Molecular Properties

Compound Name(2-phenyl-4,5-dihydro-1,3-thiazol-4-yl)methanol
PubChem CID14617414
Molecular FormulaC10H11NOS
Molecular Weight193.27 g/mol
Exact Mass193.06
IUPAC Name(2-phenyl-4,5-dihydro-1,3-thiazol-4-yl)methanol
SMILESOCC1CSC(c2ccccc2)=N1
InChIInChI=1S/C10H11NOS/c12-6-9-7-13-10(11-9)8-4-2-1-3-5-8/h1-5,9,12H,6-7H2
InChIKeyHYKRINDPYGQNSQ-UHFFFAOYSA-N
XLogP1.54
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Thiazole, 4,5-dihydro-2-phenyl-
CID 200788
5-Methyl-2-phenyl-4,5-dihydro-1,3-thiazole
CID 211414
(4R)-2-phenyl-4,5-dihydro-1,3-thiazole-4-carboxylic acid
CID 7410566
2-Phenyl-4,5-dihydro-1,3-thiazole-4-carboxylic acid
CID 88327
6H-1,3,5-Oxathiazine, 2-methyl-4-phenyl-
CID 3042018
[(4S,5S)-5-methyl-2-phenyl-4,5-dihydro-1,3-thiazol-4-yl]methanol
CID 145978113
(4S)-2-Phenyl-4,5-dihydro-thiazole-4-carboxylic acid
CID 7410568
2-Amino-3-benzylsulfanylpropan-1-ol
CID 427801
4-Methyl-2-phenyl-5,6-dihydro-1,3-thiazin-4-ol
CID 470268
(1S)-1-(Benzylthiomethyl)-2-hydroxyethylamine
CID 2817366
4-Ethyl-2-phenyl-5,6-dihydro-1,3-thiazin-4-ol
CID 470269
4-(2-methylsulfanylethyl)-2-phenyl-4H-1,3-thiazol-5-one
CID 11010427

Frequently Asked Questions

What is the IUPAC name of (2-phenyl-4,5-dihydro-1,3-thiazol-4-yl)methanol?
The IUPAC name of (2-phenyl-4,5-dihydro-1,3-thiazol-4-yl)methanol (CID 14617414) is (2-phenyl-4,5-dihydro-1,3-thiazol-4-yl)methanol.
What is the SMILES notation for (2-phenyl-4,5-dihydro-1,3-thiazol-4-yl)methanol?
The canonical SMILES for (2-phenyl-4,5-dihydro-1,3-thiazol-4-yl)methanol is OCC1CSC(c2ccccc2)=N1.
What is the InChIKey of (2-phenyl-4,5-dihydro-1,3-thiazol-4-yl)methanol?
The InChIKey is HYKRINDPYGQNSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NOS/c12-6-9-7-13-10(11-9)8-4-2-1-3-5-8/h1-5,9,12H,6-7H2.
What are the key properties of (2-phenyl-4,5-dihydro-1,3-thiazol-4-yl)methanol?
(2-phenyl-4,5-dihydro-1,3-thiazol-4-yl)methanol has a molecular weight of 193.27 g/mol, XLogP of 1.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-phenyl-4,5-dihydro-1,3-thiazol-4-yl)methanol is sourced from PubChem (CID 14617414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).