4-(2,3-dimethoxy-4,5-dimethylphenyl)piperidine

C15H23NO2 — CID 117377304

IUPAC4-(2,3-dimethoxy-4,5-dimethylphenyl)piperidine
SMILESCOc1c(C2CCNCC2)cc(C)c(C)c1OC
InChIInChI=1S/C15H23NO2/c1-10-9-13(12-5-7-16-8-6-12)15(18-4)14(17-3)11(10)2/h9,12,16H,5-8H2,1-4H3
InChIKeyFSTBWOBWOOGOHM-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.79
Rot. Bonds3

About 4-(2,3-dimethoxy-4,5-dimethylphenyl)piperidine

4-(2,3-dimethoxy-4,5-dimethylphenyl)piperidine (PubChem CID 117377304) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 4-(2,3-dimethoxy-4,5-dimethylphenyl)piperidine.

Molecular Properties

Compound Name4-(2,3-dimethoxy-4,5-dimethylphenyl)piperidine
PubChem CID117377304
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name4-(2,3-dimethoxy-4,5-dimethylphenyl)piperidine
SMILESCOc1c(C2CCNCC2)cc(C)c(C)c1OC
InChIInChI=1S/C15H23NO2/c1-10-9-13(12-5-7-16-8-6-12)15(18-4)14(17-3)11(10)2/h9,12,16H,5-8H2,1-4H3
InChIKeyFSTBWOBWOOGOHM-UHFFFAOYSA-N
XLogP2.79
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-bromo-2,4-dimethoxy-5-methylphenyl)piperidine
CID 117499537
2-fluoro-3-methoxy-6-methyl-4-piperidin-4-ylphenol
CID 84799689
3-(4-bromo-2-methoxy-3,5-dimethylphenyl)pyrrolidine
CID 117457157
4-(2,3,5-trimethylphenyl)piperidine
CID 117292122
4-(4-chloro-2-methoxy-5-methylphenyl)piperidine
CID 83392391
4-(3-chloro-2,4,5-trimethoxyphenyl)piperidine
CID 117460328
4-(4-chloro-2,3-dimethoxyphenyl)piperidine
CID 117392507
2,3,6-trimethyl-4-piperidin-4-ylphenol
CID 117116552
4-(3-fluoro-2-methoxy-5-propan-2-ylphenyl)piperidine
CID 117382003
4-(5-chloro-3-ethyl-2-methoxyphenyl)piperidine
CID 117387972
(2-methoxy-3,4,6-trimethylphenyl)-piperidin-4-ylmethanamine
CID 116935922
4-(2,4-dimethoxy-3-methylphenyl)azepane
CID 82297126

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dimethoxy-4,5-dimethylphenyl)piperidine?
The IUPAC name of 4-(2,3-dimethoxy-4,5-dimethylphenyl)piperidine (CID 117377304) is 4-(2,3-dimethoxy-4,5-dimethylphenyl)piperidine.
What is the SMILES notation for 4-(2,3-dimethoxy-4,5-dimethylphenyl)piperidine?
The canonical SMILES for 4-(2,3-dimethoxy-4,5-dimethylphenyl)piperidine is COc1c(C2CCNCC2)cc(C)c(C)c1OC.
What is the InChIKey of 4-(2,3-dimethoxy-4,5-dimethylphenyl)piperidine?
The InChIKey is FSTBWOBWOOGOHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-10-9-13(12-5-7-16-8-6-12)15(18-4)14(17-3)11(10)2/h9,12,16H,5-8H2,1-4H3.
What are the key properties of 4-(2,3-dimethoxy-4,5-dimethylphenyl)piperidine?
4-(2,3-dimethoxy-4,5-dimethylphenyl)piperidine has a molecular weight of 249.35 g/mol, XLogP of 2.79, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dimethoxy-4,5-dimethylphenyl)piperidine is sourced from PubChem (CID 117377304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).