3-ethyl-4-(furan-3-ylmethyl)piperidin-4-ol

C12H19NO2 — CID 114510379

IUPAC3-ethyl-4-(furan-3-ylmethyl)piperidin-4-ol
SMILESCCC1CNCCC1(O)Cc1ccoc1
InChIInChI=1S/C12H19NO2/c1-2-11-8-13-5-4-12(11,14)7-10-3-6-15-9-10/h3,6,9,11,13-14H,2,4-5,7-8H2,1H3
InChIKeyPESQNWYMFGXAIN-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.57
Rot. Bonds3

About 3-ethyl-4-(furan-3-ylmethyl)piperidin-4-ol

3-ethyl-4-(furan-3-ylmethyl)piperidin-4-ol (PubChem CID 114510379) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 3-ethyl-4-(furan-3-ylmethyl)piperidin-4-ol.

Molecular Properties

Compound Name3-ethyl-4-(furan-3-ylmethyl)piperidin-4-ol
PubChem CID114510379
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name3-ethyl-4-(furan-3-ylmethyl)piperidin-4-ol
SMILESCCC1CNCCC1(O)Cc1ccoc1
InChIInChI=1S/C12H19NO2/c1-2-11-8-13-5-4-12(11,14)7-10-3-6-15-9-10/h3,6,9,11,13-14H,2,4-5,7-8H2,1H3
InChIKeyPESQNWYMFGXAIN-UHFFFAOYSA-N
XLogP1.57
TPSA45.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethyl-4-(thiophen-3-ylmethyl)piperidin-4-ol
CID 114510452
4-[(2-chloro-3-fluorophenyl)methyl]-3-ethylpiperidin-4-ol
CID 114510405
3-ethyl-4-[(2-propan-2-yl-1,2,4-triazol-3-yl)methyl]piperidin-4-ol
CID 114510267
4-[(5-chloro-2-methoxyphenyl)methyl]-3-ethylpiperidin-4-ol
CID 114510368
1-(furan-3-ylmethyl)-3-methylcyclobutan-1-ol
CID 103564546
3-ethyl-4-(2-methylsulfonylethyl)piperidin-4-ol
CID 114510260
3-ethyl-4-(2-methylpentyl)piperidin-4-ol
CID 114510431
4-benzyl-3,4-diethylpiperidine
CID 79312303
1-(furan-3-ylmethyl)-3,3-dimethylcyclopentan-1-ol
CID 83173185
4-(4-tert-butylphenyl)-3-ethylpiperidin-4-ol
CID 114510286
2-(furan-3-ylmethyl)adamantan-2-ol
CID 114082142
4-[furan-3-ylmethyl(methyl)amino]pyrrolidin-3-ol
CID 63702901

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4-(furan-3-ylmethyl)piperidin-4-ol?
The IUPAC name of 3-ethyl-4-(furan-3-ylmethyl)piperidin-4-ol (CID 114510379) is 3-ethyl-4-(furan-3-ylmethyl)piperidin-4-ol.
What is the SMILES notation for 3-ethyl-4-(furan-3-ylmethyl)piperidin-4-ol?
The canonical SMILES for 3-ethyl-4-(furan-3-ylmethyl)piperidin-4-ol is CCC1CNCCC1(O)Cc1ccoc1.
What is the InChIKey of 3-ethyl-4-(furan-3-ylmethyl)piperidin-4-ol?
The InChIKey is PESQNWYMFGXAIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-2-11-8-13-5-4-12(11,14)7-10-3-6-15-9-10/h3,6,9,11,13-14H,2,4-5,7-8H2,1H3.
What are the key properties of 3-ethyl-4-(furan-3-ylmethyl)piperidin-4-ol?
3-ethyl-4-(furan-3-ylmethyl)piperidin-4-ol has a molecular weight of 209.29 g/mol, XLogP of 1.57, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4-(furan-3-ylmethyl)piperidin-4-ol is sourced from PubChem (CID 114510379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).