3,3-dimethyl-5-(2-methylphenyl)piperidine

C14H21N — CID 82282661

IUPAC3,3-dimethyl-5-(2-methylphenyl)piperidine
SMILESCc1ccccc1C1CNCC(C)(C)C1
InChIInChI=1S/C14H21N/c1-11-6-4-5-7-13(11)12-8-14(2,3)10-15-9-12/h4-7,12,15H,8-10H2,1-3H3
InChIKeyKMYRQFXAXBHTAY-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.10
Rot. Bonds1

About 3,3-dimethyl-5-(2-methylphenyl)piperidine

3,3-dimethyl-5-(2-methylphenyl)piperidine (PubChem CID 82282661) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 3,3-dimethyl-5-(2-methylphenyl)piperidine.

Molecular Properties

Compound Name3,3-dimethyl-5-(2-methylphenyl)piperidine
PubChem CID82282661
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name3,3-dimethyl-5-(2-methylphenyl)piperidine
SMILESCc1ccccc1C1CNCC(C)(C)C1
InChIInChI=1S/C14H21N/c1-11-6-4-5-7-13(11)12-8-14(2,3)10-15-9-12/h4-7,12,15H,8-10H2,1-3H3
InChIKeyKMYRQFXAXBHTAY-UHFFFAOYSA-N
XLogP3.10
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-(2-methylphenyl)-4-azaspiro[2.4]heptane
CID 105442772
[2-methyl-4-(2-methylphenyl)pyrrolidin-2-yl]methanol
CID 117270803
5-(2,4-dichlorophenyl)-3,3-dimethylpiperidine
CID 82300275
ethane;3-(2-methylphenyl)piperidine
CID 144655647
5-(4-ethylphenyl)-3,3-dimethylpiperidine
CID 82285256
5-(4-methoxyphenyl)-3,3-dimethylpiperidine
CID 82285929
3-[2-(3,3-dimethylcyclohexyl)phenyl]piperidine
CID 117431737
5,5-dimethyl-2-(2-methylphenyl)-1,3-oxazinane
CID 117227065
4,4-dimethyl-2-(2-methylphenyl)-1,3-oxazolidine;hydrochloride
CID 117228480
2-methyl-6-(2-methylphenyl)morpholine
CID 43367022
3-(2-methylphenyl)cyclobutan-1-ol
CID 60792741
2-(2-bromophenyl)-6,6-dimethyl-1,4-oxazepane
CID 115362109

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-5-(2-methylphenyl)piperidine?
The IUPAC name of 3,3-dimethyl-5-(2-methylphenyl)piperidine (CID 82282661) is 3,3-dimethyl-5-(2-methylphenyl)piperidine.
What is the SMILES notation for 3,3-dimethyl-5-(2-methylphenyl)piperidine?
The canonical SMILES for 3,3-dimethyl-5-(2-methylphenyl)piperidine is Cc1ccccc1C1CNCC(C)(C)C1.
What is the InChIKey of 3,3-dimethyl-5-(2-methylphenyl)piperidine?
The InChIKey is KMYRQFXAXBHTAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-11-6-4-5-7-13(11)12-8-14(2,3)10-15-9-12/h4-7,12,15H,8-10H2,1-3H3.
What are the key properties of 3,3-dimethyl-5-(2-methylphenyl)piperidine?
3,3-dimethyl-5-(2-methylphenyl)piperidine has a molecular weight of 203.33 g/mol, XLogP of 3.10, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-5-(2-methylphenyl)piperidine is sourced from PubChem (CID 82282661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).