1-[(3-methylfuran-2-yl)methyl]piperidin-4-ol

C11H17NO2 — CID 115880131

IUPAC1-[(3-methylfuran-2-yl)methyl]piperidin-4-ol
SMILESCc1ccoc1CN1CCC(O)CC1
InChIInChI=1S/C11H17NO2/c1-9-4-7-14-11(9)8-12-5-2-10(13)3-6-12/h4,7,10,13H,2-3,5-6,8H2,1H3
InChIKeyJOKJALRUGWCEKV-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.54
Rot. Bonds2

About 1-[(3-methylfuran-2-yl)methyl]piperidin-4-ol

1-[(3-methylfuran-2-yl)methyl]piperidin-4-ol (PubChem CID 115880131) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 1-[(3-methylfuran-2-yl)methyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[(3-methylfuran-2-yl)methyl]piperidin-4-ol
PubChem CID115880131
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name1-[(3-methylfuran-2-yl)methyl]piperidin-4-ol
SMILESCc1ccoc1CN1CCC(O)CC1
InChIInChI=1S/C11H17NO2/c1-9-4-7-14-11(9)8-12-5-2-10(13)3-6-12/h4,7,10,13H,2-3,5-6,8H2,1H3
InChIKeyJOKJALRUGWCEKV-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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Related Compounds

2-[4-[(3-methylfuran-2-yl)methyl]piperazin-1-yl]ethanol
CID 30704245
8-[(3-methylfuran-2-yl)methyl]-8-azabicyclo[3.2.1]octan-3-ol
CID 115880167
2-[1-[(3-methylfuran-2-yl)methyl]piperidin-3-yl]ethanol
CID 115882769
[(2S)-1-[(3-methylfuran-2-yl)methyl]pyrrolidin-2-yl]methanol
CID 103885811
1-(1-ethylpiperidin-4-yl)-N-[(3-methylfuran-2-yl)methyl]methanamine
CID 113243107
1-[(2-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-ol
CID 130996437
6-[(3-methylfuran-2-yl)methyl]-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridine
CID 102678662
2-(cyclopropylmethyl)-3-methylfuran
CID 54330779
1-[[5-(aminomethyl)furan-2-yl]methyl]piperidin-4-ol
CID 82508099
3-[(4-hydroxypiperidin-1-yl)methyl]furan-2-carbohydrazide
CID 63570591
2-[[4-(1-hydroxyethyl)piperidin-1-yl]methyl]furan-3-carboxylic acid
CID 106836382
1-[[1-[(2-methylphenyl)methyl]piperidin-4-yl]methyl]piperidin-4-ol
CID 67960796

Frequently Asked Questions

What is the IUPAC name of 1-[(3-methylfuran-2-yl)methyl]piperidin-4-ol?
The IUPAC name of 1-[(3-methylfuran-2-yl)methyl]piperidin-4-ol (CID 115880131) is 1-[(3-methylfuran-2-yl)methyl]piperidin-4-ol.
What is the SMILES notation for 1-[(3-methylfuran-2-yl)methyl]piperidin-4-ol?
The canonical SMILES for 1-[(3-methylfuran-2-yl)methyl]piperidin-4-ol is Cc1ccoc1CN1CCC(O)CC1.
What is the InChIKey of 1-[(3-methylfuran-2-yl)methyl]piperidin-4-ol?
The InChIKey is JOKJALRUGWCEKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-9-4-7-14-11(9)8-12-5-2-10(13)3-6-12/h4,7,10,13H,2-3,5-6,8H2,1H3.
What are the key properties of 1-[(3-methylfuran-2-yl)methyl]piperidin-4-ol?
1-[(3-methylfuran-2-yl)methyl]piperidin-4-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-[(3-methylfuran-2-yl)methyl]piperidin-4-ol is sourced from PubChem (CID 115880131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).