2-[furo[3,2-c]pyridin-4-yl(propan-2-yl)amino]ethanol

C12H16N2O2 — CID 106535445

IUPAC2-[furo[3,2-c]pyridin-4-yl(propan-2-yl)amino]ethanol
SMILESCC(C)N(CCO)c1nccc2occc12
InChIInChI=1S/C12H16N2O2/c1-9(2)14(6-7-15)12-10-4-8-16-11(10)3-5-13-12/h3-5,8-9,15H,6-7H2,1-2H3
InChIKeyPXYPGAJMOPKZPS-UHFFFAOYSA-N
MW220.27 g/mol
LogP2.03
Rot. Bonds4

About 2-[furo[3,2-c]pyridin-4-yl(propan-2-yl)amino]ethanol

2-[furo[3,2-c]pyridin-4-yl(propan-2-yl)amino]ethanol (PubChem CID 106535445) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 2-[furo[3,2-c]pyridin-4-yl(propan-2-yl)amino]ethanol.

Molecular Properties

Compound Name2-[furo[3,2-c]pyridin-4-yl(propan-2-yl)amino]ethanol
PubChem CID106535445
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name2-[furo[3,2-c]pyridin-4-yl(propan-2-yl)amino]ethanol
SMILESCC(C)N(CCO)c1nccc2occc12
InChIInChI=1S/C12H16N2O2/c1-9(2)14(6-7-15)12-10-4-8-16-11(10)3-5-13-12/h3-5,8-9,15H,6-7H2,1-2H3
InChIKeyPXYPGAJMOPKZPS-UHFFFAOYSA-N
XLogP2.03
TPSA49.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[furo[3,2-c]pyridin-4-yl(propan-2-yl)amino]ethanol?
The IUPAC name of 2-[furo[3,2-c]pyridin-4-yl(propan-2-yl)amino]ethanol (CID 106535445) is 2-[furo[3,2-c]pyridin-4-yl(propan-2-yl)amino]ethanol.
What is the SMILES notation for 2-[furo[3,2-c]pyridin-4-yl(propan-2-yl)amino]ethanol?
The canonical SMILES for 2-[furo[3,2-c]pyridin-4-yl(propan-2-yl)amino]ethanol is CC(C)N(CCO)c1nccc2occc12.
What is the InChIKey of 2-[furo[3,2-c]pyridin-4-yl(propan-2-yl)amino]ethanol?
The InChIKey is PXYPGAJMOPKZPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-9(2)14(6-7-15)12-10-4-8-16-11(10)3-5-13-12/h3-5,8-9,15H,6-7H2,1-2H3.
What are the key properties of 2-[furo[3,2-c]pyridin-4-yl(propan-2-yl)amino]ethanol?
2-[furo[3,2-c]pyridin-4-yl(propan-2-yl)amino]ethanol has a molecular weight of 220.27 g/mol, XLogP of 2.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[furo[3,2-c]pyridin-4-yl(propan-2-yl)amino]ethanol is sourced from PubChem (CID 106535445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).