1-(furan-2-yl)-2-[(1-methylpiperidin-4-yl)amino]ethanol

C12H20N2O2 — CID 60910521

IUPAC1-(furan-2-yl)-2-[(1-methylpiperidin-4-yl)amino]ethanol
SMILESCN1CCC(NCC(O)c2ccco2)CC1
InChIInChI=1S/C12H20N2O2/c1-14-6-4-10(5-7-14)13-9-11(15)12-3-2-8-16-12/h2-3,8,10-11,13,15H,4-7,9H2,1H3
InChIKeyGDNAJIGNTFOUGO-UHFFFAOYSA-N
MW224.30 g/mol
LogP1.00
Rot. Bonds4

About 1-(furan-2-yl)-2-[(1-methylpiperidin-4-yl)amino]ethanol

1-(furan-2-yl)-2-[(1-methylpiperidin-4-yl)amino]ethanol (PubChem CID 60910521) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 1-(furan-2-yl)-2-[(1-methylpiperidin-4-yl)amino]ethanol.

Molecular Properties

Compound Name1-(furan-2-yl)-2-[(1-methylpiperidin-4-yl)amino]ethanol
PubChem CID60910521
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name1-(furan-2-yl)-2-[(1-methylpiperidin-4-yl)amino]ethanol
SMILESCN1CCC(NCC(O)c2ccco2)CC1
InChIInChI=1S/C12H20N2O2/c1-14-6-4-10(5-7-14)13-9-11(15)12-3-2-8-16-12/h2-3,8,10-11,13,15H,4-7,9H2,1H3
InChIKeyGDNAJIGNTFOUGO-UHFFFAOYSA-N
XLogP1.00
TPSA48.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-2-[(1-methylpiperidin-4-yl)amino]ethanol?
The IUPAC name of 1-(furan-2-yl)-2-[(1-methylpiperidin-4-yl)amino]ethanol (CID 60910521) is 1-(furan-2-yl)-2-[(1-methylpiperidin-4-yl)amino]ethanol.
What is the SMILES notation for 1-(furan-2-yl)-2-[(1-methylpiperidin-4-yl)amino]ethanol?
The canonical SMILES for 1-(furan-2-yl)-2-[(1-methylpiperidin-4-yl)amino]ethanol is CN1CCC(NCC(O)c2ccco2)CC1.
What is the InChIKey of 1-(furan-2-yl)-2-[(1-methylpiperidin-4-yl)amino]ethanol?
The InChIKey is GDNAJIGNTFOUGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-14-6-4-10(5-7-14)13-9-11(15)12-3-2-8-16-12/h2-3,8,10-11,13,15H,4-7,9H2,1H3.
What are the key properties of 1-(furan-2-yl)-2-[(1-methylpiperidin-4-yl)amino]ethanol?
1-(furan-2-yl)-2-[(1-methylpiperidin-4-yl)amino]ethanol has a molecular weight of 224.30 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-2-[(1-methylpiperidin-4-yl)amino]ethanol is sourced from PubChem (CID 60910521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).