1-(furan-2-yl)-3-methyl-3-phenylbutan-2-ol

C15H18O2 — CID 83172363

IUPAC1-(furan-2-yl)-3-methyl-3-phenylbutan-2-ol
SMILESCC(C)(c1ccccc1)C(O)Cc1ccco1
InChIInChI=1S/C15H18O2/c1-15(2,12-7-4-3-5-8-12)14(16)11-13-9-6-10-17-13/h3-10,14,16H,11H2,1-2H3
InChIKeyAHDUAKWQBTVKLD-UHFFFAOYSA-N
MW230.31 g/mol
LogP3.16
Rot. Bonds4

About 1-(furan-2-yl)-3-methyl-3-phenylbutan-2-ol

1-(furan-2-yl)-3-methyl-3-phenylbutan-2-ol (PubChem CID 83172363) has the molecular formula C15H18O2 and a molecular weight of 230.31 g/mol. Its IUPAC name is 1-(furan-2-yl)-3-methyl-3-phenylbutan-2-ol.

Molecular Properties

Compound Name1-(furan-2-yl)-3-methyl-3-phenylbutan-2-ol
PubChem CID83172363
Molecular FormulaC15H18O2
Molecular Weight230.31 g/mol
Exact Mass230.13
IUPAC Name1-(furan-2-yl)-3-methyl-3-phenylbutan-2-ol
SMILESCC(C)(c1ccccc1)C(O)Cc1ccco1
InChIInChI=1S/C15H18O2/c1-15(2,12-7-4-3-5-8-12)14(16)11-13-9-6-10-17-13/h3-10,14,16H,11H2,1-2H3
InChIKeyAHDUAKWQBTVKLD-UHFFFAOYSA-N
XLogP3.16
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(furan-2-yl)-3-methyl-3-phenylbutan-2-yl]hydrazine
CID 105216401
2-(furan-2-yl)ethane-1,1-diol
CID 156698008
1-(4-ethylphenyl)-3-methyl-3-phenylbutan-2-ol
CID 63085891
1-(4-bromophenyl)-3-methyl-3-phenylbutan-2-ol
CID 63083837
[3-ethyl-1-(furan-2-yl)-3-phenylpentan-2-yl]hydrazine
CID 105217733
(2S)-2-(furan-2-ylmethyl)-3-[(2-methylpropan-2-yl)oxy]-3-oxopropanoic acid
CID 91666114
3-(aminomethyl)-4-(furan-2-yl)-3-methylbutan-2-ol
CID 65392790
3-(furan-2-ylmethylamino)-3-methylbutan-2-ol
CID 115866780
2-(furan-2-yl)-1-(4-phenylphenyl)ethanol
CID 83172274
1-(4-fluoro-2-methylphenyl)-3-methyl-3-phenylbutan-2-ol
CID 114347441
1-(furan-2-ylmethylamino)-3,3-dimethylbutan-2-ol
CID 115623530
2-(furan-2-ylmethyl)-3,3-dimethylbutan-1-amine
CID 83138308

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-3-methyl-3-phenylbutan-2-ol?
The IUPAC name of 1-(furan-2-yl)-3-methyl-3-phenylbutan-2-ol (CID 83172363) is 1-(furan-2-yl)-3-methyl-3-phenylbutan-2-ol.
What is the SMILES notation for 1-(furan-2-yl)-3-methyl-3-phenylbutan-2-ol?
The canonical SMILES for 1-(furan-2-yl)-3-methyl-3-phenylbutan-2-ol is CC(C)(c1ccccc1)C(O)Cc1ccco1.
What is the InChIKey of 1-(furan-2-yl)-3-methyl-3-phenylbutan-2-ol?
The InChIKey is AHDUAKWQBTVKLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O2/c1-15(2,12-7-4-3-5-8-12)14(16)11-13-9-6-10-17-13/h3-10,14,16H,11H2,1-2H3.
What are the key properties of 1-(furan-2-yl)-3-methyl-3-phenylbutan-2-ol?
1-(furan-2-yl)-3-methyl-3-phenylbutan-2-ol has a molecular weight of 230.31 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-3-methyl-3-phenylbutan-2-ol is sourced from PubChem (CID 83172363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).