1-[(5-methylfuran-2-yl)methyl]piperidin-3-ol

C11H17NO2 — CID 62022683

IUPAC1-[(5-methylfuran-2-yl)methyl]piperidin-3-ol
SMILESCc1ccc(CN2CCCC(O)C2)o1
InChIInChI=1S/C11H17NO2/c1-9-4-5-11(14-9)8-12-6-2-3-10(13)7-12/h4-5,10,13H,2-3,6-8H2,1H3
InChIKeySUXYXMKDJLWLBH-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.54
Rot. Bonds2

About 1-[(5-methylfuran-2-yl)methyl]piperidin-3-ol

1-[(5-methylfuran-2-yl)methyl]piperidin-3-ol (PubChem CID 62022683) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 1-[(5-methylfuran-2-yl)methyl]piperidin-3-ol.

Molecular Properties

Compound Name1-[(5-methylfuran-2-yl)methyl]piperidin-3-ol
PubChem CID62022683
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name1-[(5-methylfuran-2-yl)methyl]piperidin-3-ol
SMILESCc1ccc(CN2CCCC(O)C2)o1
InChIInChI=1S/C11H17NO2/c1-9-4-5-11(14-9)8-12-6-2-3-10(13)7-12/h4-5,10,13H,2-3,6-8H2,1H3
InChIKeySUXYXMKDJLWLBH-UHFFFAOYSA-N
XLogP1.54
TPSA36.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(5-methylfuran-2-yl)methyl]piperidin-3-ol?
The IUPAC name of 1-[(5-methylfuran-2-yl)methyl]piperidin-3-ol (CID 62022683) is 1-[(5-methylfuran-2-yl)methyl]piperidin-3-ol.
What is the SMILES notation for 1-[(5-methylfuran-2-yl)methyl]piperidin-3-ol?
The canonical SMILES for 1-[(5-methylfuran-2-yl)methyl]piperidin-3-ol is Cc1ccc(CN2CCCC(O)C2)o1.
What is the InChIKey of 1-[(5-methylfuran-2-yl)methyl]piperidin-3-ol?
The InChIKey is SUXYXMKDJLWLBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-9-4-5-11(14-9)8-12-6-2-3-10(13)7-12/h4-5,10,13H,2-3,6-8H2,1H3.
What are the key properties of 1-[(5-methylfuran-2-yl)methyl]piperidin-3-ol?
1-[(5-methylfuran-2-yl)methyl]piperidin-3-ol has a molecular weight of 195.26 g/mol, XLogP of 1.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-methylfuran-2-yl)methyl]piperidin-3-ol is sourced from PubChem (CID 62022683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).