1-[3-(dimethylamino)phenyl]-2-(furan-2-yl)ethanol

C14H17NO2 — CID 105122910

IUPAC1-[3-(dimethylamino)phenyl]-2-(furan-2-yl)ethanol
SMILESCN(C)c1cccc(C(O)Cc2ccco2)c1
InChIInChI=1S/C14H17NO2/c1-15(2)12-6-3-5-11(9-12)14(16)10-13-7-4-8-17-13/h3-9,14,16H,10H2,1-2H3
InChIKeyLPKOGFSKYVAOEU-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.62
Rot. Bonds4

About 1-[3-(dimethylamino)phenyl]-2-(furan-2-yl)ethanol

1-[3-(dimethylamino)phenyl]-2-(furan-2-yl)ethanol (PubChem CID 105122910) has the molecular formula C14H17NO2 and a molecular weight of 231.30 g/mol. Its IUPAC name is 1-[3-(dimethylamino)phenyl]-2-(furan-2-yl)ethanol.

Molecular Properties

Compound Name1-[3-(dimethylamino)phenyl]-2-(furan-2-yl)ethanol
PubChem CID105122910
Molecular FormulaC14H17NO2
Molecular Weight231.30 g/mol
Exact Mass231.13
IUPAC Name1-[3-(dimethylamino)phenyl]-2-(furan-2-yl)ethanol
SMILESCN(C)c1cccc(C(O)Cc2ccco2)c1
InChIInChI=1S/C14H17NO2/c1-15(2)12-6-3-5-11(9-12)14(16)10-13-7-4-8-17-13/h3-9,14,16H,10H2,1-2H3
InChIKeyLPKOGFSKYVAOEU-UHFFFAOYSA-N
XLogP2.62
TPSA36.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-(furan-2-yl)-1-(methylamino)ethyl]-N,N-dimethylaniline
CID 105177359
3-[2-(furan-2-yl)-1-hydroxyethyl]benzonitrile
CID 83173061
2-(3-bromophenyl)-1-[3-(dimethylamino)phenyl]ethanol
CID 105077529
1-[3-(dimethylamino)phenyl]-3-methylbutan-1-ol
CID 105076156
3-amino-1-[3-(dimethylamino)phenyl]propan-1-ol
CID 82605939
2-(furan-2-yl)ethane-1,1-diol
CID 156698008
1-[3-(dimethylamino)phenyl]-3-methylbut-3-en-1-ol
CID 105110020
1-[3-(dimethylamino)phenoxy]-3-(furan-2-ylmethoxy)propan-2-ol
CID 109415919
1-[3-(dimethylamino)phenyl]pent-3-yn-1-ol
CID 105082393
2-(furan-2-yl)-1-(5-methyl-3-pyridinyl)ethanol
CID 105122925
1-(2,3-dihydro-1-benzofuran-5-yl)-2-(furan-2-yl)ethanol
CID 83171228
2-(furan-2-yl)-1-(4-phenylphenyl)ethanol
CID 83172274

Frequently Asked Questions

What is the IUPAC name of 1-[3-(dimethylamino)phenyl]-2-(furan-2-yl)ethanol?
The IUPAC name of 1-[3-(dimethylamino)phenyl]-2-(furan-2-yl)ethanol (CID 105122910) is 1-[3-(dimethylamino)phenyl]-2-(furan-2-yl)ethanol.
What is the SMILES notation for 1-[3-(dimethylamino)phenyl]-2-(furan-2-yl)ethanol?
The canonical SMILES for 1-[3-(dimethylamino)phenyl]-2-(furan-2-yl)ethanol is CN(C)c1cccc(C(O)Cc2ccco2)c1.
What is the InChIKey of 1-[3-(dimethylamino)phenyl]-2-(furan-2-yl)ethanol?
The InChIKey is LPKOGFSKYVAOEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2/c1-15(2)12-6-3-5-11(9-12)14(16)10-13-7-4-8-17-13/h3-9,14,16H,10H2,1-2H3.
What are the key properties of 1-[3-(dimethylamino)phenyl]-2-(furan-2-yl)ethanol?
1-[3-(dimethylamino)phenyl]-2-(furan-2-yl)ethanol has a molecular weight of 231.30 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(dimethylamino)phenyl]-2-(furan-2-yl)ethanol is sourced from PubChem (CID 105122910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).