3-(furan-2-yl)-1-(4-propylphenyl)propan-1-ol

C16H20O2 — CID 105095239

IUPAC3-(furan-2-yl)-1-(4-propylphenyl)propan-1-ol
SMILESCCCc1ccc(C(O)CCc2ccco2)cc1
InChIInChI=1S/C16H20O2/c1-2-4-13-6-8-14(9-7-13)16(17)11-10-15-5-3-12-18-15/h3,5-9,12,16-17H,2,4,10-11H2,1H3
InChIKeyCTOYGRFOEWWDMA-UHFFFAOYSA-N
MW244.33 g/mol
LogP3.90
Rot. Bonds6

About 3-(furan-2-yl)-1-(4-propylphenyl)propan-1-ol

3-(furan-2-yl)-1-(4-propylphenyl)propan-1-ol (PubChem CID 105095239) has the molecular formula C16H20O2 and a molecular weight of 244.33 g/mol. Its IUPAC name is 3-(furan-2-yl)-1-(4-propylphenyl)propan-1-ol.

Molecular Properties

Compound Name3-(furan-2-yl)-1-(4-propylphenyl)propan-1-ol
PubChem CID105095239
Molecular FormulaC16H20O2
Molecular Weight244.33 g/mol
Exact Mass244.15
IUPAC Name3-(furan-2-yl)-1-(4-propylphenyl)propan-1-ol
SMILESCCCc1ccc(C(O)CCc2ccco2)cc1
InChIInChI=1S/C16H20O2/c1-2-4-13-6-8-14(9-7-13)16(17)11-10-15-5-3-12-18-15/h3,5-9,12,16-17H,2,4,10-11H2,1H3
InChIKeyCTOYGRFOEWWDMA-UHFFFAOYSA-N
XLogP3.90
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(furan-2-yl)butan-2-yl]-4-propylaniline
CID 43478896
1-(3,4-diethoxyphenyl)-3-(furan-2-yl)propan-1-ol
CID 105094403
1-(4-fluoro-3-methylphenyl)-3-(furan-2-yl)propan-1-ol
CID 105094003
3-(furan-2-yl)-1-(3-propylphenyl)propan-1-amine
CID 105187906
1-(2,3-dihydro-1H-inden-5-yl)-3-(furan-2-yl)propan-1-ol
CID 114195082
4,4-dimethyl-1-(4-propylphenyl)pentan-1-ol
CID 114211492
3-(methylamino)-1-(4-propylphenyl)propan-1-ol
CID 112509803
1-(4-ethylphenyl)-2-(furan-2-ylmethylamino)ethanol
CID 112501576
N'-[4-(furan-2-yl)butan-2-yl]butanimidamide
CID 63177351
2-(3-methylhexyl)furan
CID 12840321
5-hydroxy-5-(4-propylphenyl)pentanoic acid
CID 43117855
furan-2-yl-(4-propylphenyl)methanamine
CID 43464285

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-1-(4-propylphenyl)propan-1-ol?
The IUPAC name of 3-(furan-2-yl)-1-(4-propylphenyl)propan-1-ol (CID 105095239) is 3-(furan-2-yl)-1-(4-propylphenyl)propan-1-ol.
What is the SMILES notation for 3-(furan-2-yl)-1-(4-propylphenyl)propan-1-ol?
The canonical SMILES for 3-(furan-2-yl)-1-(4-propylphenyl)propan-1-ol is CCCc1ccc(C(O)CCc2ccco2)cc1.
What is the InChIKey of 3-(furan-2-yl)-1-(4-propylphenyl)propan-1-ol?
The InChIKey is CTOYGRFOEWWDMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20O2/c1-2-4-13-6-8-14(9-7-13)16(17)11-10-15-5-3-12-18-15/h3,5-9,12,16-17H,2,4,10-11H2,1H3.
What are the key properties of 3-(furan-2-yl)-1-(4-propylphenyl)propan-1-ol?
3-(furan-2-yl)-1-(4-propylphenyl)propan-1-ol has a molecular weight of 244.33 g/mol, XLogP of 3.90, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-1-(4-propylphenyl)propan-1-ol is sourced from PubChem (CID 105095239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).