2-[1-[2-amino-1-(furan-2-yl)ethyl]piperidin-4-yl]oxyethanol

C13H22N2O3 — CID 82696071

IUPAC2-[1-[2-amino-1-(furan-2-yl)ethyl]piperidin-4-yl]oxyethanol
SMILESNCC(c1ccco1)N1CCC(OCCO)CC1
InChIInChI=1S/C13H22N2O3/c14-10-12(13-2-1-8-18-13)15-5-3-11(4-6-15)17-9-7-16/h1-2,8,11-12,16H,3-7,9-10,14H2
InChIKeyQCUKKDYLBWDGFN-UHFFFAOYSA-N
MW254.33 g/mol
LogP0.75
Rot. Bonds6

About 2-[1-[2-amino-1-(furan-2-yl)ethyl]piperidin-4-yl]oxyethanol

2-[1-[2-amino-1-(furan-2-yl)ethyl]piperidin-4-yl]oxyethanol (PubChem CID 82696071) has the molecular formula C13H22N2O3 and a molecular weight of 254.33 g/mol. Its IUPAC name is 2-[1-[2-amino-1-(furan-2-yl)ethyl]piperidin-4-yl]oxyethanol.

Molecular Properties

Compound Name2-[1-[2-amino-1-(furan-2-yl)ethyl]piperidin-4-yl]oxyethanol
PubChem CID82696071
Molecular FormulaC13H22N2O3
Molecular Weight254.33 g/mol
Exact Mass254.16
IUPAC Name2-[1-[2-amino-1-(furan-2-yl)ethyl]piperidin-4-yl]oxyethanol
SMILESNCC(c1ccco1)N1CCC(OCCO)CC1
InChIInChI=1S/C13H22N2O3/c14-10-12(13-2-1-8-18-13)15-5-3-11(4-6-15)17-9-7-16/h1-2,8,11-12,16H,3-7,9-10,14H2
InChIKeyQCUKKDYLBWDGFN-UHFFFAOYSA-N
XLogP0.75
TPSA71.86 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[1-[2-amino-1-(5-methylfuran-2-yl)ethyl]piperidin-4-yl]oxyethanol
CID 82696659
3-[1-[1-(furan-2-yl)propyl]piperidin-4-yl]oxypropan-1-amine
CID 79732715
2-(furan-2-yl)-2-(3-methoxypyrrolidin-1-yl)ethanamine
CID 103530810
[1-[2-amino-1-(furan-2-yl)ethyl]pyrrolidin-3-yl]methanol
CID 112624466
2-(furan-2-yl)-2-(4-propylpiperidin-1-yl)ethanamine
CID 55050220
2-(4-benzylpiperidin-1-yl)-2-(furan-2-yl)ethanamine
CID 43346331
1-[2-amino-1-(furan-2-yl)ethyl]-4-methylpiperidin-3-ol
CID 102956003
1-[2-amino-1-(furan-2-yl)ethyl]azetidin-3-ol
CID 131207499
2-(3-tert-butylpyrrolidin-1-yl)-2-(furan-2-yl)ethanamine
CID 113416920
2-(4,4-diethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine
CID 63156988
tert-butyl 4-[2-amino-1-(furan-2-yl)ethyl]piperazine-1-carboxylate
CID 82020206
2-(3-ethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine
CID 43584299

Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-amino-1-(furan-2-yl)ethyl]piperidin-4-yl]oxyethanol?
The IUPAC name of 2-[1-[2-amino-1-(furan-2-yl)ethyl]piperidin-4-yl]oxyethanol (CID 82696071) is 2-[1-[2-amino-1-(furan-2-yl)ethyl]piperidin-4-yl]oxyethanol.
What is the SMILES notation for 2-[1-[2-amino-1-(furan-2-yl)ethyl]piperidin-4-yl]oxyethanol?
The canonical SMILES for 2-[1-[2-amino-1-(furan-2-yl)ethyl]piperidin-4-yl]oxyethanol is NCC(c1ccco1)N1CCC(OCCO)CC1.
What is the InChIKey of 2-[1-[2-amino-1-(furan-2-yl)ethyl]piperidin-4-yl]oxyethanol?
The InChIKey is QCUKKDYLBWDGFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O3/c14-10-12(13-2-1-8-18-13)15-5-3-11(4-6-15)17-9-7-16/h1-2,8,11-12,16H,3-7,9-10,14H2.
What are the key properties of 2-[1-[2-amino-1-(furan-2-yl)ethyl]piperidin-4-yl]oxyethanol?
2-[1-[2-amino-1-(furan-2-yl)ethyl]piperidin-4-yl]oxyethanol has a molecular weight of 254.33 g/mol, XLogP of 0.75, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-amino-1-(furan-2-yl)ethyl]piperidin-4-yl]oxyethanol is sourced from PubChem (CID 82696071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).