1-(furan-2-yl)-3-(3-methoxyphenoxy)propan-2-ol

C14H16O4 — CID 117246144

IUPAC1-(furan-2-yl)-3-(3-methoxyphenoxy)propan-2-ol
SMILESCOc1cccc(OCC(O)Cc2ccco2)c1
InChIInChI=1S/C14H16O4/c1-16-12-4-2-5-14(9-12)18-10-11(15)8-13-6-3-7-17-13/h2-7,9,11,15H,8,10H2,1H3
InChIKeyRHASDTWTHZVMGE-UHFFFAOYSA-N
MW248.28 g/mol
LogP2.27
Rot. Bonds6

About 1-(furan-2-yl)-3-(3-methoxyphenoxy)propan-2-ol

1-(furan-2-yl)-3-(3-methoxyphenoxy)propan-2-ol (PubChem CID 117246144) has the molecular formula C14H16O4 and a molecular weight of 248.28 g/mol. Its IUPAC name is 1-(furan-2-yl)-3-(3-methoxyphenoxy)propan-2-ol.

Molecular Properties

Compound Name1-(furan-2-yl)-3-(3-methoxyphenoxy)propan-2-ol
PubChem CID117246144
Molecular FormulaC14H16O4
Molecular Weight248.28 g/mol
Exact Mass248.10
IUPAC Name1-(furan-2-yl)-3-(3-methoxyphenoxy)propan-2-ol
SMILESCOc1cccc(OCC(O)Cc2ccco2)c1
InChIInChI=1S/C14H16O4/c1-16-12-4-2-5-14(9-12)18-10-11(15)8-13-6-3-7-17-13/h2-7,9,11,15H,8,10H2,1H3
InChIKeyRHASDTWTHZVMGE-UHFFFAOYSA-N
XLogP2.27
TPSA51.83 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(furan-2-yl)-3-(4-methoxyphenoxy)propan-2-ol
CID 117246167
1-(furan-2-yl)-3-(3-methylphenoxy)propan-2-ol
CID 117246130
1-[1-(furan-2-yl)ethylamino]-3-(3-methoxyphenoxy)propan-2-ol
CID 60909460
1-iodo-3-(3-methoxyphenoxy)propan-2-ol
CID 86028408
1-(3-aminophenoxy)-3-(3-methoxyphenoxy)propan-2-ol
CID 62269535
1-(3-methoxyphenoxy)-5-methylhexan-2-ol
CID 157099262
2-(furan-2-ylmethyl)-3-(3-methoxyphenyl)propan-1-ol
CID 66058670
3-hydroxy-4-(3-methoxyphenoxy)butanenitrile
CID 13010437
1-(2,2-difluoroethylamino)-3-(3-methoxyphenoxy)propan-2-ol
CID 115406734
1-[3-(dimethylamino)phenoxy]-3-(furan-2-ylmethoxy)propan-2-ol
CID 109415919
1-(3-chlorophenoxy)-3-(furan-2-ylmethoxy)propan-2-ol
CID 167784638
2-(furan-2-ylmethyl)-3-(3-methoxyphenyl)propanoic acid
CID 63000304

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-3-(3-methoxyphenoxy)propan-2-ol?
The IUPAC name of 1-(furan-2-yl)-3-(3-methoxyphenoxy)propan-2-ol (CID 117246144) is 1-(furan-2-yl)-3-(3-methoxyphenoxy)propan-2-ol.
What is the SMILES notation for 1-(furan-2-yl)-3-(3-methoxyphenoxy)propan-2-ol?
The canonical SMILES for 1-(furan-2-yl)-3-(3-methoxyphenoxy)propan-2-ol is COc1cccc(OCC(O)Cc2ccco2)c1.
What is the InChIKey of 1-(furan-2-yl)-3-(3-methoxyphenoxy)propan-2-ol?
The InChIKey is RHASDTWTHZVMGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16O4/c1-16-12-4-2-5-14(9-12)18-10-11(15)8-13-6-3-7-17-13/h2-7,9,11,15H,8,10H2,1H3.
What are the key properties of 1-(furan-2-yl)-3-(3-methoxyphenoxy)propan-2-ol?
1-(furan-2-yl)-3-(3-methoxyphenoxy)propan-2-ol has a molecular weight of 248.28 g/mol, XLogP of 2.27, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-3-(3-methoxyphenoxy)propan-2-ol is sourced from PubChem (CID 117246144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).