3-(4-phenylmethoxyphenyl)propan-1-ol

C16H18O2 — CID 2764076

IUPAC3-(4-phenylmethoxyphenyl)propan-1-ol
SMILESOCCCc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C16H18O2/c17-12-4-7-14-8-10-16(11-9-14)18-13-15-5-2-1-3-6-15/h1-3,5-6,8-11,17H,4,7,12-13H2
InChIKeyFZALPKMIIYFLAP-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.19
Rot. Bonds6

About 3-(4-phenylmethoxyphenyl)propan-1-ol

3-(4-phenylmethoxyphenyl)propan-1-ol (PubChem CID 2764076) has the molecular formula C16H18O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 3-(4-phenylmethoxyphenyl)propan-1-ol.

Molecular Properties

Compound Name3-(4-phenylmethoxyphenyl)propan-1-ol
PubChem CID2764076
Molecular FormulaC16H18O2
Molecular Weight242.32 g/mol
Exact Mass242.13
IUPAC Name3-(4-phenylmethoxyphenyl)propan-1-ol
SMILESOCCCc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C16H18O2/c17-12-4-7-14-8-10-16(11-9-14)18-13-15-5-2-1-3-6-15/h1-3,5-6,8-11,17H,4,7,12-13H2
InChIKeyFZALPKMIIYFLAP-UHFFFAOYSA-N
XLogP3.19
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-phenylmethoxyphenyl)propan-1-ol?
The IUPAC name of 3-(4-phenylmethoxyphenyl)propan-1-ol (CID 2764076) is 3-(4-phenylmethoxyphenyl)propan-1-ol.
What is the SMILES notation for 3-(4-phenylmethoxyphenyl)propan-1-ol?
The canonical SMILES for 3-(4-phenylmethoxyphenyl)propan-1-ol is OCCCc1ccc(OCc2ccccc2)cc1.
What is the InChIKey of 3-(4-phenylmethoxyphenyl)propan-1-ol?
The InChIKey is FZALPKMIIYFLAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O2/c17-12-4-7-14-8-10-16(11-9-14)18-13-15-5-2-1-3-6-15/h1-3,5-6,8-11,17H,4,7,12-13H2.
What are the key properties of 3-(4-phenylmethoxyphenyl)propan-1-ol?
3-(4-phenylmethoxyphenyl)propan-1-ol has a molecular weight of 242.32 g/mol, XLogP of 3.19, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-phenylmethoxyphenyl)propan-1-ol is sourced from PubChem (CID 2764076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).