(3-phenylmethoxyphenyl)-thiophen-2-ylmethanol

C18H16O2S — CID 2904667

IUPAC(3-phenylmethoxyphenyl)-thiophen-2-ylmethanol
SMILESOC(c1cccc(OCc2ccccc2)c1)c1cccs1
InChIInChI=1S/C18H16O2S/c19-18(17-10-5-11-21-17)15-8-4-9-16(12-15)20-13-14-6-2-1-3-7-14/h1-12,18-19H,13H2
InChIKeyYPNRORHJPXPVEH-UHFFFAOYSA-N
MW296.39 g/mol
LogP4.41
Rot. Bonds5

About (3-phenylmethoxyphenyl)-thiophen-2-ylmethanol

(3-phenylmethoxyphenyl)-thiophen-2-ylmethanol (PubChem CID 2904667) has the molecular formula C18H16O2S and a molecular weight of 296.39 g/mol. Its IUPAC name is (3-phenylmethoxyphenyl)-thiophen-2-ylmethanol.

Molecular Properties

Compound Name(3-phenylmethoxyphenyl)-thiophen-2-ylmethanol
PubChem CID2904667
Molecular FormulaC18H16O2S
Molecular Weight296.39 g/mol
Exact Mass296.09
IUPAC Name(3-phenylmethoxyphenyl)-thiophen-2-ylmethanol
SMILESOC(c1cccc(OCc2ccccc2)c1)c1cccs1
InChIInChI=1S/C18H16O2S/c19-18(17-10-5-11-21-17)15-8-4-9-16(12-15)20-13-14-6-2-1-3-7-14/h1-12,18-19H,13H2
InChIKeyYPNRORHJPXPVEH-UHFFFAOYSA-N
XLogP4.41
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.39
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3,5-dimethoxyphenyl)-(3-phenylmethoxyphenyl)methanol
CID 69204493
3-(3-phenylmethoxyphenyl)-2-thiophen-2-ylpropanoic acid
CID 83952104
1-(3-phenylmethoxyphenyl)propane-1,2-diol
CID 137375721
(1S,2R)-1-amino-1-(3-phenylmethoxyphenyl)propan-2-ol
CID 171270166
(2R)-2-amino-2-(3-phenylmethoxyphenyl)ethanol
CID 66515455
(1S)-2,2-dimethyl-1-(3-phenylmethoxyphenyl)propan-1-amine;hydrochloride
CID 171243477
3-hydroxy-3-(3-phenylmethoxyphenyl)propanamide
CID 68644594
(S)-(3-phenylmethoxyphenyl)-thiophen-3-ylmethanamine
CID 171211288
3,5-bis(3-phenylmethoxyphenyl)heptan-4-one
CID 139719265
1-[3-(thiophen-2-ylmethoxy)phenyl]ethanol
CID 43504299
(1S)-1-[3-(thiophen-2-ylmethoxy)phenyl]ethanol
CID 78933301
(S)-(3-phenylmethoxyphenyl)-thiophen-3-ylmethanamine;hydrochloride
CID 171211289

Frequently Asked Questions

What is the IUPAC name of (3-phenylmethoxyphenyl)-thiophen-2-ylmethanol?
The IUPAC name of (3-phenylmethoxyphenyl)-thiophen-2-ylmethanol (CID 2904667) is (3-phenylmethoxyphenyl)-thiophen-2-ylmethanol.
What is the SMILES notation for (3-phenylmethoxyphenyl)-thiophen-2-ylmethanol?
The canonical SMILES for (3-phenylmethoxyphenyl)-thiophen-2-ylmethanol is OC(c1cccc(OCc2ccccc2)c1)c1cccs1.
What is the InChIKey of (3-phenylmethoxyphenyl)-thiophen-2-ylmethanol?
The InChIKey is YPNRORHJPXPVEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16O2S/c19-18(17-10-5-11-21-17)15-8-4-9-16(12-15)20-13-14-6-2-1-3-7-14/h1-12,18-19H,13H2.
What are the key properties of (3-phenylmethoxyphenyl)-thiophen-2-ylmethanol?
(3-phenylmethoxyphenyl)-thiophen-2-ylmethanol has a molecular weight of 296.39 g/mol, XLogP of 4.41, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-phenylmethoxyphenyl)-thiophen-2-ylmethanol is sourced from PubChem (CID 2904667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).