3-(2,4-dimethylphenyl)-N,N-dimethylpiperidin-4-amine

C15H24N2 — CID 117000283

IUPAC3-(2,4-dimethylphenyl)-N,N-dimethylpiperidin-4-amine
SMILESCc1ccc(C2CNCCC2N(C)C)c(C)c1
InChIInChI=1S/C15H24N2/c1-11-5-6-13(12(2)9-11)14-10-16-8-7-15(14)17(3)4/h5-6,9,14-16H,7-8,10H2,1-4H3
InChIKeyGFBMIEQIYRSSBD-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.31
Rot. Bonds2

About 3-(2,4-dimethylphenyl)-N,N-dimethylpiperidin-4-amine

3-(2,4-dimethylphenyl)-N,N-dimethylpiperidin-4-amine (PubChem CID 117000283) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 3-(2,4-dimethylphenyl)-N,N-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name3-(2,4-dimethylphenyl)-N,N-dimethylpiperidin-4-amine
PubChem CID117000283
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name3-(2,4-dimethylphenyl)-N,N-dimethylpiperidin-4-amine
SMILESCc1ccc(C2CNCCC2N(C)C)c(C)c1
InChIInChI=1S/C15H24N2/c1-11-5-6-13(12(2)9-11)14-10-16-8-7-15(14)17(3)4/h5-6,9,14-16H,7-8,10H2,1-4H3
InChIKeyGFBMIEQIYRSSBD-UHFFFAOYSA-N
XLogP2.31
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2,4-dimethylphenyl)piperidine
CID 10535662
3-(2,5-dimethylphenyl)-4-methylpiperidine
CID 66273596
(2S)-2-(2,4-dimethylphenyl)piperazine
CID 55264314
N-(2,4-dimethylphenyl)-N-methylpyrrolidin-3-amine
CID 78989080
4-chloro-N-[(3R,4R)-3-(4-fluoro-2-methylphenyl)piperidin-4-yl]-N-methylbenzamide;hydrochloride
CID 68930315
(2R)-2-(2,4-dimethylphenyl)piperazine;hydrochloride
CID 171194638
4-(2-methylphenyl)-3-(3-methylphenyl)piperidine
CID 79441677
(4aR,9bS)-7-methyl-1,2,3,4,4a,9b-hexahydroindeno[1,2-c]pyridin-5-one
CID 59083233
2-[3,5-bis(trifluoromethyl)phenyl]-N-[(3S,4S)-3-(4-fluoro-2-methylphenyl)piperidin-4-yl]-N,2-dimethylpropanamide
CID 58990758
(4aS,10bR)-8-methyl-1,2,3,4,4a,10b-hexahydrobenzo[f]isoquinoline
CID 12850461
2,4-dimethyl-1-(2-methylcyclopropyl)benzene
CID 154093761
6-(2,4-dimethylphenyl)-3-azabicyclo[3.1.0]hexane
CID 83817723

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dimethylphenyl)-N,N-dimethylpiperidin-4-amine?
The IUPAC name of 3-(2,4-dimethylphenyl)-N,N-dimethylpiperidin-4-amine (CID 117000283) is 3-(2,4-dimethylphenyl)-N,N-dimethylpiperidin-4-amine.
What is the SMILES notation for 3-(2,4-dimethylphenyl)-N,N-dimethylpiperidin-4-amine?
The canonical SMILES for 3-(2,4-dimethylphenyl)-N,N-dimethylpiperidin-4-amine is Cc1ccc(C2CNCCC2N(C)C)c(C)c1.
What is the InChIKey of 3-(2,4-dimethylphenyl)-N,N-dimethylpiperidin-4-amine?
The InChIKey is GFBMIEQIYRSSBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-11-5-6-13(12(2)9-11)14-10-16-8-7-15(14)17(3)4/h5-6,9,14-16H,7-8,10H2,1-4H3.
What are the key properties of 3-(2,4-dimethylphenyl)-N,N-dimethylpiperidin-4-amine?
3-(2,4-dimethylphenyl)-N,N-dimethylpiperidin-4-amine has a molecular weight of 232.37 g/mol, XLogP of 2.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dimethylphenyl)-N,N-dimethylpiperidin-4-amine is sourced from PubChem (CID 117000283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).