2-(furan-2-yl)-2-[1-(3-methoxyphenyl)ethylamino]ethanol

C15H19NO3 — CID 111755821

IUPAC2-(furan-2-yl)-2-[1-(3-methoxyphenyl)ethylamino]ethanol
SMILESCOc1cccc(C(C)NC(CO)c2ccco2)c1
InChIInChI=1S/C15H19NO3/c1-11(12-5-3-6-13(9-12)18-2)16-14(10-17)15-7-4-8-19-15/h3-9,11,14,16-17H,10H2,1-2H3
InChIKeyCQPQLQNGXNSZMS-UHFFFAOYSA-N
MW261.32 g/mol
LogP2.67
Rot. Bonds6

About 2-(furan-2-yl)-2-[1-(3-methoxyphenyl)ethylamino]ethanol

2-(furan-2-yl)-2-[1-(3-methoxyphenyl)ethylamino]ethanol (PubChem CID 111755821) has the molecular formula C15H19NO3 and a molecular weight of 261.32 g/mol. Its IUPAC name is 2-(furan-2-yl)-2-[1-(3-methoxyphenyl)ethylamino]ethanol.

Molecular Properties

Compound Name2-(furan-2-yl)-2-[1-(3-methoxyphenyl)ethylamino]ethanol
PubChem CID111755821
Molecular FormulaC15H19NO3
Molecular Weight261.32 g/mol
Exact Mass261.14
IUPAC Name2-(furan-2-yl)-2-[1-(3-methoxyphenyl)ethylamino]ethanol
SMILESCOc1cccc(C(C)NC(CO)c2ccco2)c1
InChIInChI=1S/C15H19NO3/c1-11(12-5-3-6-13(9-12)18-2)16-14(10-17)15-7-4-8-19-15/h3-9,11,14,16-17H,10H2,1-2H3
InChIKeyCQPQLQNGXNSZMS-UHFFFAOYSA-N
XLogP2.67
TPSA54.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(1S)-N-[1-(furan-2-yl)ethyl]-1-(3-methoxyphenyl)ethanamine
CID 81376667
(3R)-3-[1-(3-methoxyphenyl)ethylamino]-3-phenylpropan-1-ol
CID 111755727
1-(furan-2-yl)-N'-[1-(3-methoxyphenyl)ethyl]-N,N-dimethylethane-1,2-diamine
CID 43202378
N-[(1R)-1-(3-chlorophenyl)ethyl]-1-(furan-2-yl)propan-1-amine
CID 81366262
4-[1-[1-(3-methoxyphenyl)ethylamino]ethyl]phenol
CID 60944294
N-[(1S)-1-(3-methoxyphenyl)ethyl]-5-methylhexan-2-amine
CID 81376515
(2R)-2-[1-(3-methoxyphenyl)propylamino]propan-1-ol
CID 103778510
(2S)-2-[[(1S)-1-(3-methoxyphenyl)ethyl]amino]propanoic acid
CID 94212365
N-[1-(3-methoxyphenyl)ethyl]-1-phenylbutan-1-amine
CID 43720331
1-(furan-2-yl)-N-(1-phenylethyl)propan-1-amine
CID 62631959
2-[1-(3-methoxyphenyl)ethylamino]-3-phenylpropan-1-ol
CID 63260760
3-[[(1R)-1-(3-methoxyphenyl)ethyl]amino]-2-methylpropan-1-ol
CID 104881509

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-2-[1-(3-methoxyphenyl)ethylamino]ethanol?
The IUPAC name of 2-(furan-2-yl)-2-[1-(3-methoxyphenyl)ethylamino]ethanol (CID 111755821) is 2-(furan-2-yl)-2-[1-(3-methoxyphenyl)ethylamino]ethanol.
What is the SMILES notation for 2-(furan-2-yl)-2-[1-(3-methoxyphenyl)ethylamino]ethanol?
The canonical SMILES for 2-(furan-2-yl)-2-[1-(3-methoxyphenyl)ethylamino]ethanol is COc1cccc(C(C)NC(CO)c2ccco2)c1.
What is the InChIKey of 2-(furan-2-yl)-2-[1-(3-methoxyphenyl)ethylamino]ethanol?
The InChIKey is CQPQLQNGXNSZMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO3/c1-11(12-5-3-6-13(9-12)18-2)16-14(10-17)15-7-4-8-19-15/h3-9,11,14,16-17H,10H2,1-2H3.
What are the key properties of 2-(furan-2-yl)-2-[1-(3-methoxyphenyl)ethylamino]ethanol?
2-(furan-2-yl)-2-[1-(3-methoxyphenyl)ethylamino]ethanol has a molecular weight of 261.32 g/mol, XLogP of 2.67, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-2-[1-(3-methoxyphenyl)ethylamino]ethanol is sourced from PubChem (CID 111755821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).