2-(2-methoxy-3,4-dimethylphenyl)-3-methylpiperidine

C15H23NO — CID 106781936

IUPAC2-(2-methoxy-3,4-dimethylphenyl)-3-methylpiperidine
SMILESCOc1c(C2NCCCC2C)ccc(C)c1C
InChIInChI=1S/C15H23NO/c1-10-7-8-13(15(17-4)12(10)3)14-11(2)6-5-9-16-14/h7-8,11,14,16H,5-6,9H2,1-4H3
InChIKeyPTWIOGLOCPDUKC-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.37
Rot. Bonds2

About 2-(2-methoxy-3,4-dimethylphenyl)-3-methylpiperidine

2-(2-methoxy-3,4-dimethylphenyl)-3-methylpiperidine (PubChem CID 106781936) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 2-(2-methoxy-3,4-dimethylphenyl)-3-methylpiperidine.

Molecular Properties

Compound Name2-(2-methoxy-3,4-dimethylphenyl)-3-methylpiperidine
PubChem CID106781936
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name2-(2-methoxy-3,4-dimethylphenyl)-3-methylpiperidine
SMILESCOc1c(C2NCCCC2C)ccc(C)c1C
InChIInChI=1S/C15H23NO/c1-10-7-8-13(15(17-4)12(10)3)14-11(2)6-5-9-16-14/h7-8,11,14,16H,5-6,9H2,1-4H3
InChIKeyPTWIOGLOCPDUKC-UHFFFAOYSA-N
XLogP3.37
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-methoxy-3,4-dimethylphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline
CID 106781932
3-(3-methoxy-2,4-dimethylphenyl)pyrrolidine
CID 117293921
2-(2-methoxy-3,4-dimethylphenyl)-N-methylcycloheptan-1-amine
CID 103434249
(3R)-3-methyl-2-phenylpiperidine
CID 155222992
2-methoxy-3-methyl-6-piperidin-2-ylphenol
CID 84686849
4-(2,4-dimethoxy-3-methylphenyl)azepane
CID 82297126
2-(4-methoxy-2,3,5-trimethylphenyl)pyrrolidine
CID 82286064
3-(3-bromo-2-methoxy-4-methylphenyl)piperidine
CID 115004613
2-[(2-methoxy-3,4-dimethylphenyl)methyl]-5-methylpiperidine
CID 103434193
2-(2-methoxy-3-methylphenyl)azepane
CID 5021978
7-methoxy-1,2,3,4,4a,5,6,10b-octahydrobenzo[h]quinoline
CID 83887769
6,7-dimethoxy-1-methyl-2,3,4,5-tetrahydro-1H-2-benzazepine
CID 83691109

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-3,4-dimethylphenyl)-3-methylpiperidine?
The IUPAC name of 2-(2-methoxy-3,4-dimethylphenyl)-3-methylpiperidine (CID 106781936) is 2-(2-methoxy-3,4-dimethylphenyl)-3-methylpiperidine.
What is the SMILES notation for 2-(2-methoxy-3,4-dimethylphenyl)-3-methylpiperidine?
The canonical SMILES for 2-(2-methoxy-3,4-dimethylphenyl)-3-methylpiperidine is COc1c(C2NCCCC2C)ccc(C)c1C.
What is the InChIKey of 2-(2-methoxy-3,4-dimethylphenyl)-3-methylpiperidine?
The InChIKey is PTWIOGLOCPDUKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-10-7-8-13(15(17-4)12(10)3)14-11(2)6-5-9-16-14/h7-8,11,14,16H,5-6,9H2,1-4H3.
What are the key properties of 2-(2-methoxy-3,4-dimethylphenyl)-3-methylpiperidine?
2-(2-methoxy-3,4-dimethylphenyl)-3-methylpiperidine has a molecular weight of 233.35 g/mol, XLogP of 3.37, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-3,4-dimethylphenyl)-3-methylpiperidine is sourced from PubChem (CID 106781936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).