4-ethyl-2-fluoro-6-(piperidin-4-ylmethyl)phenol

C14H20FNO — CID 84798682

IUPAC4-ethyl-2-fluoro-6-(piperidin-4-ylmethyl)phenol
SMILESCCc1cc(F)c(O)c(CC2CCNCC2)c1
InChIInChI=1S/C14H20FNO/c1-2-10-7-12(14(17)13(15)9-10)8-11-3-5-16-6-4-11/h7,9,11,16-17H,2-6,8H2,1H3
InChIKeyGUVDNGGDMDJZBO-UHFFFAOYSA-N
MW237.32 g/mol
LogP2.64
Rot. Bonds3

About 4-ethyl-2-fluoro-6-(piperidin-4-ylmethyl)phenol

4-ethyl-2-fluoro-6-(piperidin-4-ylmethyl)phenol (PubChem CID 84798682) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is 4-ethyl-2-fluoro-6-(piperidin-4-ylmethyl)phenol.

Molecular Properties

Compound Name4-ethyl-2-fluoro-6-(piperidin-4-ylmethyl)phenol
PubChem CID84798682
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name4-ethyl-2-fluoro-6-(piperidin-4-ylmethyl)phenol
SMILESCCc1cc(F)c(O)c(CC2CCNCC2)c1
InChIInChI=1S/C14H20FNO/c1-2-10-7-12(14(17)13(15)9-10)8-11-3-5-16-6-4-11/h7,9,11,16-17H,2-6,8H2,1H3
InChIKeyGUVDNGGDMDJZBO-UHFFFAOYSA-N
XLogP2.64
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-4-ethyl-6-(piperidin-4-ylmethyl)phenol
CID 117387726
4-[(5-ethyl-3-fluoro-2-methoxyphenyl)methyl]piperidine
CID 117382042
2,3,4-trifluoro-6-(piperidin-4-ylmethyl)phenol
CID 117364515
3-ethyl-5-(piperidin-4-ylmethyl)phenol
CID 117312985
4-fluoro-2-methyl-6-(piperidin-4-ylmethyl)phenol
CID 84789132
4-chloro-2-fluoro-6-(pyrrolidin-3-ylmethyl)phenol
CID 84793216
2,5-difluoro-4-(piperidin-4-ylmethyl)phenol
CID 117326872
2,3,4-trifluoro-6-(pyrrolidin-3-ylmethyl)phenol
CID 84794176
2,4-difluoro-3-methylsulfonyl-6-(piperidin-4-ylmethyl)phenol
CID 117490642
4-[(2,3,4,5-tetrafluorophenyl)methyl]piperidine
CID 117117923
4-fluoro-6-(piperidin-4-ylmethyl)-1,3-benzodioxol-5-ol
CID 117385671
4,5-dimethyl-2-(piperidin-4-ylmethyl)phenol
CID 84786987

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-fluoro-6-(piperidin-4-ylmethyl)phenol?
The IUPAC name of 4-ethyl-2-fluoro-6-(piperidin-4-ylmethyl)phenol (CID 84798682) is 4-ethyl-2-fluoro-6-(piperidin-4-ylmethyl)phenol.
What is the SMILES notation for 4-ethyl-2-fluoro-6-(piperidin-4-ylmethyl)phenol?
The canonical SMILES for 4-ethyl-2-fluoro-6-(piperidin-4-ylmethyl)phenol is CCc1cc(F)c(O)c(CC2CCNCC2)c1.
What is the InChIKey of 4-ethyl-2-fluoro-6-(piperidin-4-ylmethyl)phenol?
The InChIKey is GUVDNGGDMDJZBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c1-2-10-7-12(14(17)13(15)9-10)8-11-3-5-16-6-4-11/h7,9,11,16-17H,2-6,8H2,1H3.
What are the key properties of 4-ethyl-2-fluoro-6-(piperidin-4-ylmethyl)phenol?
4-ethyl-2-fluoro-6-(piperidin-4-ylmethyl)phenol has a molecular weight of 237.32 g/mol, XLogP of 2.64, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-fluoro-6-(piperidin-4-ylmethyl)phenol is sourced from PubChem (CID 84798682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).