2-phenylmethoxy-4,5-dihydro-1,3-thiazole

C10H11NOS — CID 174841495

IUPAC2-phenylmethoxy-4,5-dihydro-1,3-thiazole
SMILESc1ccc(COC2=NCCS2)cc1
InChIInChI=1S/C10H11NOS/c1-2-4-9(5-3-1)8-12-10-11-6-7-13-10/h1-5H,6-8H2
InChIKeySHYDVGJYWWXPRV-UHFFFAOYSA-N
MW193.27 g/mol
LogP2.31
Rot. Bonds2

About 2-phenylmethoxy-4,5-dihydro-1,3-thiazole

2-phenylmethoxy-4,5-dihydro-1,3-thiazole (PubChem CID 174841495) has the molecular formula C10H11NOS and a molecular weight of 193.27 g/mol. Its IUPAC name is 2-phenylmethoxy-4,5-dihydro-1,3-thiazole.

Molecular Properties

Compound Name2-phenylmethoxy-4,5-dihydro-1,3-thiazole
PubChem CID174841495
Molecular FormulaC10H11NOS
Molecular Weight193.27 g/mol
Exact Mass193.06
IUPAC Name2-phenylmethoxy-4,5-dihydro-1,3-thiazole
SMILESc1ccc(COC2=NCCS2)cc1
InChIInChI=1S/C10H11NOS/c1-2-4-9(5-3-1)8-12-10-11-6-7-13-10/h1-5H,6-8H2
InChIKeySHYDVGJYWWXPRV-UHFFFAOYSA-N
XLogP2.31
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,5-diiodo-4-phenylmethoxyphenyl)-4,5-dihydro-1,3-thiazole
CID 132593082
1-(4,5-dihydro-1,3-thiazol-2-ylmethyl)-3-phenylmethoxypyridin-4-one
CID 6482123
3,6-bis(phenylmethoxy)pyridazine
CID 68982842
2,3,6,7,10,11-hexakis(phenylmethoxy)triphenylene
CID 11040205
3-phenylmethoxy-2H-thiophen-5-one
CID 86101899
N-(4,5-dihydro-1,3-thiazol-2-yl)-3-(3-ethoxy-4-phenylmethoxyphenyl)prop-2-enamide
CID 3666645
1-phenylmethoxy-4-[9-(4-phenylmethoxyphenoxy)nonoxy]benzene
CID 43835980
4-(4-phenylmethoxyphenyl)-2,3-dihydropyridine
CID 172710264
2-methyl-5-phenylmethoxypyrazine
CID 129054090
[2,3,4,5,6-pentakis(phenylmethoxy)cyclohexyl]oxymethylbenzene
CID 10747453
2-phenylsulfanyl-4,5-dihydro-1,3-thiazole
CID 22016883
[4-(trifluoromethyl)cyclohexa-1,3-dien-1-yl]oxymethylbenzene
CID 147017621

Frequently Asked Questions

What is the IUPAC name of 2-phenylmethoxy-4,5-dihydro-1,3-thiazole?
The IUPAC name of 2-phenylmethoxy-4,5-dihydro-1,3-thiazole (CID 174841495) is 2-phenylmethoxy-4,5-dihydro-1,3-thiazole.
What is the SMILES notation for 2-phenylmethoxy-4,5-dihydro-1,3-thiazole?
The canonical SMILES for 2-phenylmethoxy-4,5-dihydro-1,3-thiazole is c1ccc(COC2=NCCS2)cc1.
What is the InChIKey of 2-phenylmethoxy-4,5-dihydro-1,3-thiazole?
The InChIKey is SHYDVGJYWWXPRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NOS/c1-2-4-9(5-3-1)8-12-10-11-6-7-13-10/h1-5H,6-8H2.
What are the key properties of 2-phenylmethoxy-4,5-dihydro-1,3-thiazole?
2-phenylmethoxy-4,5-dihydro-1,3-thiazole has a molecular weight of 193.27 g/mol, XLogP of 2.31, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylmethoxy-4,5-dihydro-1,3-thiazole is sourced from PubChem (CID 174841495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).