[5-[[(5-fluoro-2-pyridinyl)amino]methyl]furan-2-yl]methanol

C11H11FN2O2 — CID 115925040

IUPAC[5-[[(5-fluoro-2-pyridinyl)amino]methyl]furan-2-yl]methanol
SMILESOCc1ccc(CNc2ccc(F)cn2)o1
InChIInChI=1S/C11H11FN2O2/c12-8-1-4-11(13-5-8)14-6-9-2-3-10(7-15)16-9/h1-5,15H,6-7H2,(H,13,14)
InChIKeyNPEDYGZVVHGQCQ-UHFFFAOYSA-N
MW222.22 g/mol
LogP1.92
Rot. Bonds4

About [5-[[(5-fluoro-2-pyridinyl)amino]methyl]furan-2-yl]methanol

[5-[[(5-fluoro-2-pyridinyl)amino]methyl]furan-2-yl]methanol (PubChem CID 115925040) has the molecular formula C11H11FN2O2 and a molecular weight of 222.22 g/mol. Its IUPAC name is [5-[[(5-fluoro-2-pyridinyl)amino]methyl]furan-2-yl]methanol.

Molecular Properties

Compound Name[5-[[(5-fluoro-2-pyridinyl)amino]methyl]furan-2-yl]methanol
PubChem CID115925040
Molecular FormulaC11H11FN2O2
Molecular Weight222.22 g/mol
Exact Mass222.08
IUPAC Name[5-[[(5-fluoro-2-pyridinyl)amino]methyl]furan-2-yl]methanol
SMILESOCc1ccc(CNc2ccc(F)cn2)o1
InChIInChI=1S/C11H11FN2O2/c12-8-1-4-11(13-5-8)14-6-9-2-3-10(7-15)16-9/h1-5,15H,6-7H2,(H,13,14)
InChIKeyNPEDYGZVVHGQCQ-UHFFFAOYSA-N
XLogP1.92
TPSA58.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.22
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [5-[[(5-fluoro-2-pyridinyl)amino]methyl]furan-2-yl]methanol?
The IUPAC name of [5-[[(5-fluoro-2-pyridinyl)amino]methyl]furan-2-yl]methanol (CID 115925040) is [5-[[(5-fluoro-2-pyridinyl)amino]methyl]furan-2-yl]methanol.
What is the SMILES notation for [5-[[(5-fluoro-2-pyridinyl)amino]methyl]furan-2-yl]methanol?
The canonical SMILES for [5-[[(5-fluoro-2-pyridinyl)amino]methyl]furan-2-yl]methanol is OCc1ccc(CNc2ccc(F)cn2)o1.
What is the InChIKey of [5-[[(5-fluoro-2-pyridinyl)amino]methyl]furan-2-yl]methanol?
The InChIKey is NPEDYGZVVHGQCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O2/c12-8-1-4-11(13-5-8)14-6-9-2-3-10(7-15)16-9/h1-5,15H,6-7H2,(H,13,14).
What are the key properties of [5-[[(5-fluoro-2-pyridinyl)amino]methyl]furan-2-yl]methanol?
[5-[[(5-fluoro-2-pyridinyl)amino]methyl]furan-2-yl]methanol has a molecular weight of 222.22 g/mol, XLogP of 1.92, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[[(5-fluoro-2-pyridinyl)amino]methyl]furan-2-yl]methanol is sourced from PubChem (CID 115925040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).