2-[1-(5-ethoxyfuran-2-yl)ethylamino]propan-1-ol

C11H19NO3 — CID 165454067

IUPAC2-[1-(5-ethoxyfuran-2-yl)ethylamino]propan-1-ol
SMILESCCOc1ccc(C(C)NC(C)CO)o1
InChIInChI=1S/C11H19NO3/c1-4-14-11-6-5-10(15-11)9(3)12-8(2)7-13/h5-6,8-9,12-13H,4,7H2,1-3H3
InChIKeyFEBCUSCWNJSCQZ-UHFFFAOYSA-N
MW213.28 g/mol
LogP1.71
Rot. Bonds6

About 2-[1-(5-ethoxyfuran-2-yl)ethylamino]propan-1-ol

2-[1-(5-ethoxyfuran-2-yl)ethylamino]propan-1-ol (PubChem CID 165454067) has the molecular formula C11H19NO3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 2-[1-(5-ethoxyfuran-2-yl)ethylamino]propan-1-ol.

Molecular Properties

Compound Name2-[1-(5-ethoxyfuran-2-yl)ethylamino]propan-1-ol
PubChem CID165454067
Molecular FormulaC11H19NO3
Molecular Weight213.28 g/mol
Exact Mass213.14
IUPAC Name2-[1-(5-ethoxyfuran-2-yl)ethylamino]propan-1-ol
SMILESCCOc1ccc(C(C)NC(C)CO)o1
InChIInChI=1S/C11H19NO3/c1-4-14-11-6-5-10(15-11)9(3)12-8(2)7-13/h5-6,8-9,12-13H,4,7H2,1-3H3
InChIKeyFEBCUSCWNJSCQZ-UHFFFAOYSA-N
XLogP1.71
TPSA54.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(5-ethoxyfuran-2-yl)-N-ethylethanamine
CID 165454062
2-[1-(5-methylfuran-2-yl)ethylamino]butan-1-ol
CID 43207118
(3R)-3-[1-(5-ethylfuran-2-yl)ethylamino]butan-1-ol
CID 103871772
(2S)-2-[1-(5-bromofuran-2-yl)ethylamino]butan-1-ol
CID 104980490
(3R)-3-[1-(5-methylfuran-2-yl)ethylamino]butan-1-ol
CID 103871755
(2S)-2-[1-(2,5-dimethylphenyl)ethylamino]propan-1-ol
CID 103788966
(2S)-2-[1-(2-ethoxyphenyl)ethylamino]butan-1-ol
CID 104980453
(2R)-2-[[(1S)-1-(2,5-difluorophenyl)ethyl]amino]propan-1-ol
CID 93082624
5-fluoro-2-[1-(1-hydroxypropan-2-ylamino)ethyl]phenol
CID 63066726
4-bromo-2-[1-[[(2S)-1-hydroxypropan-2-yl]amino]ethyl]phenol
CID 104583031
(4R)-4-[[(1S)-1-(5-methylfuran-2-yl)ethyl]amino]pentan-1-ol
CID 97051651
(2R)-2-[[(1R)-1-(4-methylphenyl)ethyl]amino]propan-1-ol
CID 93082887

Frequently Asked Questions

What is the IUPAC name of 2-[1-(5-ethoxyfuran-2-yl)ethylamino]propan-1-ol?
The IUPAC name of 2-[1-(5-ethoxyfuran-2-yl)ethylamino]propan-1-ol (CID 165454067) is 2-[1-(5-ethoxyfuran-2-yl)ethylamino]propan-1-ol.
What is the SMILES notation for 2-[1-(5-ethoxyfuran-2-yl)ethylamino]propan-1-ol?
The canonical SMILES for 2-[1-(5-ethoxyfuran-2-yl)ethylamino]propan-1-ol is CCOc1ccc(C(C)NC(C)CO)o1.
What is the InChIKey of 2-[1-(5-ethoxyfuran-2-yl)ethylamino]propan-1-ol?
The InChIKey is FEBCUSCWNJSCQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3/c1-4-14-11-6-5-10(15-11)9(3)12-8(2)7-13/h5-6,8-9,12-13H,4,7H2,1-3H3.
What are the key properties of 2-[1-(5-ethoxyfuran-2-yl)ethylamino]propan-1-ol?
2-[1-(5-ethoxyfuran-2-yl)ethylamino]propan-1-ol has a molecular weight of 213.28 g/mol, XLogP of 1.71, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(5-ethoxyfuran-2-yl)ethylamino]propan-1-ol is sourced from PubChem (CID 165454067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).