5-methoxy-4-methyl-2-(piperidin-4-ylmethyl)phenol

C14H21NO2 — CID 84797533

IUPAC5-methoxy-4-methyl-2-(piperidin-4-ylmethyl)phenol
SMILESCOc1cc(O)c(CC2CCNCC2)cc1C
InChIInChI=1S/C14H21NO2/c1-10-7-12(13(16)9-14(10)17-2)8-11-3-5-15-6-4-11/h7,9,11,15-16H,3-6,8H2,1-2H3
InChIKeyXULYCRIWJWWSGV-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.25
Rot. Bonds3

About 5-methoxy-4-methyl-2-(piperidin-4-ylmethyl)phenol

5-methoxy-4-methyl-2-(piperidin-4-ylmethyl)phenol (PubChem CID 84797533) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 5-methoxy-4-methyl-2-(piperidin-4-ylmethyl)phenol.

Molecular Properties

Compound Name5-methoxy-4-methyl-2-(piperidin-4-ylmethyl)phenol
PubChem CID84797533
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name5-methoxy-4-methyl-2-(piperidin-4-ylmethyl)phenol
SMILESCOc1cc(O)c(CC2CCNCC2)cc1C
InChIInChI=1S/C14H21NO2/c1-10-7-12(13(16)9-14(10)17-2)8-11-3-5-15-6-4-11/h7,9,11,15-16H,3-6,8H2,1-2H3
InChIKeyXULYCRIWJWWSGV-UHFFFAOYSA-N
XLogP2.25
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-methoxy-4-methyl-2-(pyrrolidin-3-ylmethyl)phenol
CID 84787982
4,5-dimethyl-2-(piperidin-4-ylmethyl)phenol
CID 84786987
5-fluoro-2-methoxy-4-(piperidin-4-ylmethyl)phenol
CID 84799660
4-[(5-fluoro-2-methoxy-4-methylphenyl)methyl]piperidine
CID 84798681
N-[(4-methoxy-2,5-dimethylphenyl)methyl]-1-piperidin-4-ylmethanamine
CID 115209939
3,4-dimethoxy-5-(piperidin-4-ylmethyl)phenol
CID 117381520
methyl 2-hydroxy-4-methoxy-5-(piperidin-4-ylmethyl)benzoate
CID 117447967
4-[(2-fluoro-4,5-dimethoxyphenyl)methyl]piperidine
CID 117386379
4-[(5-chloro-2-methoxy-4-methylphenyl)methyl]piperidine
CID 82298661
4-fluoro-2-methyl-6-(piperidin-4-ylmethyl)phenol
CID 84789132
2-methoxy-6-(piperidin-4-ylmethyl)phenol
CID 117316216
4-[(2,3-dimethoxy-5-methylphenyl)methyl]piperidine
CID 117377234

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-4-methyl-2-(piperidin-4-ylmethyl)phenol?
The IUPAC name of 5-methoxy-4-methyl-2-(piperidin-4-ylmethyl)phenol (CID 84797533) is 5-methoxy-4-methyl-2-(piperidin-4-ylmethyl)phenol.
What is the SMILES notation for 5-methoxy-4-methyl-2-(piperidin-4-ylmethyl)phenol?
The canonical SMILES for 5-methoxy-4-methyl-2-(piperidin-4-ylmethyl)phenol is COc1cc(O)c(CC2CCNCC2)cc1C.
What is the InChIKey of 5-methoxy-4-methyl-2-(piperidin-4-ylmethyl)phenol?
The InChIKey is XULYCRIWJWWSGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-10-7-12(13(16)9-14(10)17-2)8-11-3-5-15-6-4-11/h7,9,11,15-16H,3-6,8H2,1-2H3.
What are the key properties of 5-methoxy-4-methyl-2-(piperidin-4-ylmethyl)phenol?
5-methoxy-4-methyl-2-(piperidin-4-ylmethyl)phenol has a molecular weight of 235.33 g/mol, XLogP of 2.25, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-4-methyl-2-(piperidin-4-ylmethyl)phenol is sourced from PubChem (CID 84797533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).