3-(2-methoxyphenyl)-3,5,5-trimethylpiperidine

C15H23NO — CID 82290208

IUPAC3-(2-methoxyphenyl)-3,5,5-trimethylpiperidine
SMILESCOc1ccccc1C1(C)CNCC(C)(C)C1
InChIInChI=1S/C15H23NO/c1-14(2)9-15(3,11-16-10-14)12-7-5-6-8-13(12)17-4/h5-8,16H,9-11H2,1-4H3
InChIKeyQKSQPGNBRHIMMT-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.97
Rot. Bonds2

About 3-(2-methoxyphenyl)-3,5,5-trimethylpiperidine

3-(2-methoxyphenyl)-3,5,5-trimethylpiperidine (PubChem CID 82290208) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 3-(2-methoxyphenyl)-3,5,5-trimethylpiperidine.

Molecular Properties

Compound Name3-(2-methoxyphenyl)-3,5,5-trimethylpiperidine
PubChem CID82290208
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name3-(2-methoxyphenyl)-3,5,5-trimethylpiperidine
SMILESCOc1ccccc1C1(C)CNCC(C)(C)C1
InChIInChI=1S/C15H23NO/c1-14(2)9-15(3,11-16-10-14)12-7-5-6-8-13(12)17-4/h5-8,16H,9-11H2,1-4H3
InChIKeyQKSQPGNBRHIMMT-UHFFFAOYSA-N
XLogP2.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2,5-dimethoxyphenyl)-3,5,5-trimethylpiperidine
CID 82303319
3-(2-methoxyphenyl)-3-methylpyrrolidine
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CID 115017877
4-(2-methoxyphenyl)-N,N-dimethylpiperidin-4-amine
CID 82290945
1-(2-methoxyphenyl)-3,3-dimethylcyclobutane-1-carboxylic acid
CID 65000873
1-(2-methoxyphenyl)-3,5-dimethyladamantane
CID 59318507
5-(2-methoxyphenyl)spiro[2.3]hexan-5-amine
CID 65008758
3-methoxy-3-(2-methoxyphenyl)piperidine
CID 83822639
1-(1-fluorocyclopropyl)-2-methoxybenzene
CID 22940038
2-(2-methoxyphenyl)-2,4,4-trimethyl-1,3-oxazolidine
CID 117228515
2-(2-methoxyphenyl)-2,5,5-trimethyl-1,3-oxazolidine
CID 117229119
3-(2-fluoro-3-methoxyphenyl)azetidin-3-ol
CID 82008577

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyphenyl)-3,5,5-trimethylpiperidine?
The IUPAC name of 3-(2-methoxyphenyl)-3,5,5-trimethylpiperidine (CID 82290208) is 3-(2-methoxyphenyl)-3,5,5-trimethylpiperidine.
What is the SMILES notation for 3-(2-methoxyphenyl)-3,5,5-trimethylpiperidine?
The canonical SMILES for 3-(2-methoxyphenyl)-3,5,5-trimethylpiperidine is COc1ccccc1C1(C)CNCC(C)(C)C1.
What is the InChIKey of 3-(2-methoxyphenyl)-3,5,5-trimethylpiperidine?
The InChIKey is QKSQPGNBRHIMMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-14(2)9-15(3,11-16-10-14)12-7-5-6-8-13(12)17-4/h5-8,16H,9-11H2,1-4H3.
What are the key properties of 3-(2-methoxyphenyl)-3,5,5-trimethylpiperidine?
3-(2-methoxyphenyl)-3,5,5-trimethylpiperidine has a molecular weight of 233.36 g/mol, XLogP of 2.97, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenyl)-3,5,5-trimethylpiperidine is sourced from PubChem (CID 82290208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).