(2S)-2-amino-2-[4-(furan-2-yl)phenyl]ethanol

C12H13NO2 — CID 66514043

IUPAC(2S)-2-amino-2-[4-(furan-2-yl)phenyl]ethanol
SMILESN[C@H](CO)c1ccc(-c2ccco2)cc1
InChIInChI=1S/C12H13NO2/c13-11(8-14)9-3-5-10(6-4-9)12-2-1-7-15-12/h1-7,11,14H,8,13H2/t11-/m1/s1
InChIKeyUNSGXFDZQWTIDI-LLVKDONJSA-N
MW203.24 g/mol
LogP1.94
Rot. Bonds3

About (2S)-2-amino-2-[4-(furan-2-yl)phenyl]ethanol

(2S)-2-amino-2-[4-(furan-2-yl)phenyl]ethanol (PubChem CID 66514043) has the molecular formula C12H13NO2 and a molecular weight of 203.24 g/mol. Its IUPAC name is (2S)-2-amino-2-[4-(furan-2-yl)phenyl]ethanol.

Molecular Properties

Compound Name(2S)-2-amino-2-[4-(furan-2-yl)phenyl]ethanol
PubChem CID66514043
Molecular FormulaC12H13NO2
Molecular Weight203.24 g/mol
Exact Mass203.09
IUPAC Name(2S)-2-amino-2-[4-(furan-2-yl)phenyl]ethanol
SMILESN[C@H](CO)c1ccc(-c2ccco2)cc1
InChIInChI=1S/C12H13NO2/c13-11(8-14)9-3-5-10(6-4-9)12-2-1-7-15-12/h1-7,11,14H,8,13H2/t11-/m1/s1
InChIKeyUNSGXFDZQWTIDI-LLVKDONJSA-N
XLogP1.94
TPSA59.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-3-[4-(furan-2-yl)phenyl]propanamide
CID 170876318
2-amino-2-(furan-2-yl)ethanol
CID 54048773
3-amino-1-[4-[4-(furan-2-yl)phenyl]phenyl]-3-(hydroxymethyl)butane-1,4-diol
CID 140658057
2-[4-(furan-2-yl)phenyl]ethanol
CID 168524630
1-[4-(furan-2-yl)phenyl]-N-methylethanamine
CID 63949148
4-[(1R)-1-amino-2-hydroxyethyl]phenol
CID 45083049
3-[[4-(furan-2-yl)phenyl]methoxy]propane-1,2-diol
CID 139514349
(2R)-2-amino-2-(4-thiophen-2-ylphenyl)ethanol
CID 66514267
zinc;tris((2S)-2-amino-2-phenylethanol);dichloride
CID 175904832
2-amino-2-(4-fluorophenyl)ethanol
CID 14853201
(2S)-2-amino-2-phenylethanol;methanol
CID 160824062
(2R)-2-amino-2-[4-(4-methyl-1,3-oxazol-5-yl)phenyl]ethanol
CID 171604295

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-2-[4-(furan-2-yl)phenyl]ethanol?
The IUPAC name of (2S)-2-amino-2-[4-(furan-2-yl)phenyl]ethanol (CID 66514043) is (2S)-2-amino-2-[4-(furan-2-yl)phenyl]ethanol.
What is the SMILES notation for (2S)-2-amino-2-[4-(furan-2-yl)phenyl]ethanol?
The canonical SMILES for (2S)-2-amino-2-[4-(furan-2-yl)phenyl]ethanol is N[C@H](CO)c1ccc(-c2ccco2)cc1.
What is the InChIKey of (2S)-2-amino-2-[4-(furan-2-yl)phenyl]ethanol?
The InChIKey is UNSGXFDZQWTIDI-LLVKDONJSA-N. The full InChI is InChI=1S/C12H13NO2/c13-11(8-14)9-3-5-10(6-4-9)12-2-1-7-15-12/h1-7,11,14H,8,13H2/t11-/m1/s1.
What are the key properties of (2S)-2-amino-2-[4-(furan-2-yl)phenyl]ethanol?
(2S)-2-amino-2-[4-(furan-2-yl)phenyl]ethanol has a molecular weight of 203.24 g/mol, XLogP of 1.94, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-2-[4-(furan-2-yl)phenyl]ethanol is sourced from PubChem (CID 66514043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).