2-[(2,6-dimethoxy-3-methylphenyl)methyl]piperidine

C15H23NO2 — CID 117377139

IUPAC2-[(2,6-dimethoxy-3-methylphenyl)methyl]piperidine
SMILESCOc1ccc(C)c(OC)c1CC1CCCCN1
InChIInChI=1S/C15H23NO2/c1-11-7-8-14(17-2)13(15(11)18-3)10-12-6-4-5-9-16-12/h7-8,12,16H,4-6,9-10H2,1-3H3
InChIKeyDGGVYBWEURQSBM-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.70
Rot. Bonds4

About 2-[(2,6-dimethoxy-3-methylphenyl)methyl]piperidine

2-[(2,6-dimethoxy-3-methylphenyl)methyl]piperidine (PubChem CID 117377139) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-[(2,6-dimethoxy-3-methylphenyl)methyl]piperidine.

Molecular Properties

Compound Name2-[(2,6-dimethoxy-3-methylphenyl)methyl]piperidine
PubChem CID117377139
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-[(2,6-dimethoxy-3-methylphenyl)methyl]piperidine
SMILESCOc1ccc(C)c(OC)c1CC1CCCCN1
InChIInChI=1S/C15H23NO2/c1-11-7-8-14(17-2)13(15(11)18-3)10-12-6-4-5-9-16-12/h7-8,12,16H,4-6,9-10H2,1-3H3
InChIKeyDGGVYBWEURQSBM-UHFFFAOYSA-N
XLogP2.70
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2,3,6-trimethoxyphenyl)methyl]piperidine
CID 117417665
2-[(6-chloro-2-methoxy-3-methylphenyl)methyl]piperidine
CID 117387667
2-[(6-ethyl-2,3-dimethoxyphenyl)methyl]piperidine
CID 117413480
2-[(2-methoxy-6-methylphenyl)methyl]pyrrolidine
CID 84778649
2-[(3,6-dimethoxy-2-methylsulfonylphenyl)methyl]piperidine
CID 117498779
2-[(2,3-dimethoxy-5,6-dimethylphenyl)methyl]pyrrolidine
CID 117377110
2-[(2-chloro-3,6-dimethoxy-4-methylphenyl)methyl]pyrrolidine
CID 117427732
2-[(2,4-dimethoxy-3-methylsulfanylphenyl)methyl]piperidine
CID 117451909
2-[(3-chloro-4-methoxyphenyl)methyl]piperidine
CID 82084437
2-[[2,3-dimethoxy-6-(trifluoromethyl)phenyl]methyl]pyrrolidine
CID 117467262
2-[(2,3,5-trimethoxyphenyl)methyl]piperidine
CID 117417667
3-methoxy-2-(pyrrolidin-2-ylmethyl)phenol
CID 117296060

Frequently Asked Questions

What is the IUPAC name of 2-[(2,6-dimethoxy-3-methylphenyl)methyl]piperidine?
The IUPAC name of 2-[(2,6-dimethoxy-3-methylphenyl)methyl]piperidine (CID 117377139) is 2-[(2,6-dimethoxy-3-methylphenyl)methyl]piperidine.
What is the SMILES notation for 2-[(2,6-dimethoxy-3-methylphenyl)methyl]piperidine?
The canonical SMILES for 2-[(2,6-dimethoxy-3-methylphenyl)methyl]piperidine is COc1ccc(C)c(OC)c1CC1CCCCN1.
What is the InChIKey of 2-[(2,6-dimethoxy-3-methylphenyl)methyl]piperidine?
The InChIKey is DGGVYBWEURQSBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-11-7-8-14(17-2)13(15(11)18-3)10-12-6-4-5-9-16-12/h7-8,12,16H,4-6,9-10H2,1-3H3.
What are the key properties of 2-[(2,6-dimethoxy-3-methylphenyl)methyl]piperidine?
2-[(2,6-dimethoxy-3-methylphenyl)methyl]piperidine has a molecular weight of 249.35 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,6-dimethoxy-3-methylphenyl)methyl]piperidine is sourced from PubChem (CID 117377139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).