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

C16H18O3 — CID 105131514

IUPAC1-(3-cyclopropyloxyphenyl)-3-(furan-2-yl)propan-1-ol
SMILESOC(CCc1ccco1)c1cccc(OC2CC2)c1
InChIInChI=1S/C16H18O3/c17-16(9-8-13-5-2-10-18-13)12-3-1-4-15(11-12)19-14-6-7-14/h1-5,10-11,14,16-17H,6-9H2
InChIKeyIJHCIKMTDUSNIY-UHFFFAOYSA-N
MW258.32 g/mol
LogP3.49
Rot. Bonds6

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

1-(3-cyclopropyloxyphenyl)-3-(furan-2-yl)propan-1-ol (PubChem CID 105131514) has the molecular formula C16H18O3 and a molecular weight of 258.32 g/mol. Its IUPAC name is 1-(3-cyclopropyloxyphenyl)-3-(furan-2-yl)propan-1-ol.

Molecular Properties

Compound Name1-(3-cyclopropyloxyphenyl)-3-(furan-2-yl)propan-1-ol
PubChem CID105131514
Molecular FormulaC16H18O3
Molecular Weight258.32 g/mol
Exact Mass258.13
IUPAC Name1-(3-cyclopropyloxyphenyl)-3-(furan-2-yl)propan-1-ol
SMILESOC(CCc1ccco1)c1cccc(OC2CC2)c1
InChIInChI=1S/C16H18O3/c17-16(9-8-13-5-2-10-18-13)12-3-1-4-15(11-12)19-14-6-7-14/h1-5,10-11,14,16-17H,6-9H2
InChIKeyIJHCIKMTDUSNIY-UHFFFAOYSA-N
XLogP3.49
TPSA42.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-cyclopropyloxyphenyl)-4-ethoxybutan-1-ol
CID 105131562
1-(3-cyclopropyloxyphenyl)-3-propoxypropan-1-ol
CID 105131518
1-(3,4-diethoxyphenyl)-3-(furan-2-yl)propan-1-ol
CID 105094403
1-(3-cyclopropyloxyphenyl)-2-(3-ethoxycyclobutyl)ethanol
CID 103170310
1-(3-cyclopropyloxyphenyl)-2-(4-methylphenyl)ethanol
CID 114521316
1-(2,3-dihydro-1H-inden-5-yl)-3-(furan-2-yl)propan-1-ol
CID 114195082
1-(3-cyclopropyloxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol
CID 105131484
1-(3-cyclopropyloxyphenyl)-3,5,5-trimethylhexan-1-ol
CID 115838493
2-amino-1-(3-cyclohexyloxyphenyl)ethanol
CID 83824323
1-(3-cyclopropyloxyphenyl)-2-propoxyethanol
CID 114521314
1-(3-cyclopropyloxyphenyl)-3,4,4-trimethylpentan-1-ol
CID 115838526
1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(furan-2-yl)propan-1-ol
CID 105094293

Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclopropyloxyphenyl)-3-(furan-2-yl)propan-1-ol?
The IUPAC name of 1-(3-cyclopropyloxyphenyl)-3-(furan-2-yl)propan-1-ol (CID 105131514) is 1-(3-cyclopropyloxyphenyl)-3-(furan-2-yl)propan-1-ol.
What is the SMILES notation for 1-(3-cyclopropyloxyphenyl)-3-(furan-2-yl)propan-1-ol?
The canonical SMILES for 1-(3-cyclopropyloxyphenyl)-3-(furan-2-yl)propan-1-ol is OC(CCc1ccco1)c1cccc(OC2CC2)c1.
What is the InChIKey of 1-(3-cyclopropyloxyphenyl)-3-(furan-2-yl)propan-1-ol?
The InChIKey is IJHCIKMTDUSNIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O3/c17-16(9-8-13-5-2-10-18-13)12-3-1-4-15(11-12)19-14-6-7-14/h1-5,10-11,14,16-17H,6-9H2.
What are the key properties of 1-(3-cyclopropyloxyphenyl)-3-(furan-2-yl)propan-1-ol?
1-(3-cyclopropyloxyphenyl)-3-(furan-2-yl)propan-1-ol has a molecular weight of 258.32 g/mol, XLogP of 3.49, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclopropyloxyphenyl)-3-(furan-2-yl)propan-1-ol is sourced from PubChem (CID 105131514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).