1-[[5-(aminomethyl)furan-2-yl]methyl]piperidin-4-ol

C11H18N2O2 — CID 82508099

IUPAC1-[[5-(aminomethyl)furan-2-yl]methyl]piperidin-4-ol
SMILESNCc1ccc(CN2CCC(O)CC2)o1
InChIInChI=1S/C11H18N2O2/c12-7-10-1-2-11(15-10)8-13-5-3-9(14)4-6-13/h1-2,9,14H,3-8,12H2
InChIKeyJBDDWRSIAFCUEW-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.69
Rot. Bonds3

About 1-[[5-(aminomethyl)furan-2-yl]methyl]piperidin-4-ol

1-[[5-(aminomethyl)furan-2-yl]methyl]piperidin-4-ol (PubChem CID 82508099) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 1-[[5-(aminomethyl)furan-2-yl]methyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[[5-(aminomethyl)furan-2-yl]methyl]piperidin-4-ol
PubChem CID82508099
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name1-[[5-(aminomethyl)furan-2-yl]methyl]piperidin-4-ol
SMILESNCc1ccc(CN2CCC(O)CC2)o1
InChIInChI=1S/C11H18N2O2/c12-7-10-1-2-11(15-10)8-13-5-3-9(14)4-6-13/h1-2,9,14H,3-8,12H2
InChIKeyJBDDWRSIAFCUEW-UHFFFAOYSA-N
XLogP0.69
TPSA62.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[5-[(4-propylpiperidin-1-yl)methyl]furan-2-yl]methanamine
CID 62439493
[5-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]furan-2-yl]methanamine
CID 63167064
[5-[(4-hydroxypiperidin-1-yl)methyl]furan-2-yl]-piperidin-1-ylmethanone
CID 15675405
[5-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]furan-2-yl]methanamine
CID 62419652
[5-[(3-methylpiperidin-1-yl)methyl]furan-2-yl]methanamine
CID 62438530
[5-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]furan-2-yl]methanamine
CID 62417134
[5-[(2,4-dimethylpiperidin-1-yl)methyl]furan-2-yl]methanamine
CID 62429634
[5-(2,3,3a,4,5,6,7,7a-octahydroindol-1-ylmethyl)furan-2-yl]methanamine
CID 82750611
4-[[5-(morpholin-4-ylmethyl)furan-2-yl]methyl]morpholine
CID 155546801
3-[(4-hydroxypiperidin-1-yl)methyl]furan-2-carbohydrazide
CID 63570591
1-[(5-chlorofuran-2-yl)methyl]-6,6-dimethylazepan-4-ol
CID 131905273
1-[(3-methylfuran-2-yl)methyl]piperidin-4-ol
CID 115880131

Frequently Asked Questions

What is the IUPAC name of 1-[[5-(aminomethyl)furan-2-yl]methyl]piperidin-4-ol?
The IUPAC name of 1-[[5-(aminomethyl)furan-2-yl]methyl]piperidin-4-ol (CID 82508099) is 1-[[5-(aminomethyl)furan-2-yl]methyl]piperidin-4-ol.
What is the SMILES notation for 1-[[5-(aminomethyl)furan-2-yl]methyl]piperidin-4-ol?
The canonical SMILES for 1-[[5-(aminomethyl)furan-2-yl]methyl]piperidin-4-ol is NCc1ccc(CN2CCC(O)CC2)o1.
What is the InChIKey of 1-[[5-(aminomethyl)furan-2-yl]methyl]piperidin-4-ol?
The InChIKey is JBDDWRSIAFCUEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c12-7-10-1-2-11(15-10)8-13-5-3-9(14)4-6-13/h1-2,9,14H,3-8,12H2.
What are the key properties of 1-[[5-(aminomethyl)furan-2-yl]methyl]piperidin-4-ol?
1-[[5-(aminomethyl)furan-2-yl]methyl]piperidin-4-ol has a molecular weight of 210.28 g/mol, XLogP of 0.69, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[5-(aminomethyl)furan-2-yl]methyl]piperidin-4-ol is sourced from PubChem (CID 82508099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).