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

C15H24N2 — CID 117000312

IUPAC2-(2,3-dimethylphenyl)-N,N-dimethylpiperidin-4-amine
SMILESCc1cccc(C2CC(N(C)C)CCN2)c1C
InChIInChI=1S/C15H24N2/c1-11-6-5-7-14(12(11)2)15-10-13(17(3)4)8-9-16-15/h5-7,13,15-16H,8-10H2,1-4H3
InChIKeyIRBINIXXUDKLNQ-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.66
Rot. Bonds2

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

2-(2,3-dimethylphenyl)-N,N-dimethylpiperidin-4-amine (PubChem CID 117000312) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 2-(2,3-dimethylphenyl)-N,N-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name2-(2,3-dimethylphenyl)-N,N-dimethylpiperidin-4-amine
PubChem CID117000312
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name2-(2,3-dimethylphenyl)-N,N-dimethylpiperidin-4-amine
SMILESCc1cccc(C2CC(N(C)C)CCN2)c1C
InChIInChI=1S/C15H24N2/c1-11-6-5-7-14(12(11)2)15-10-13(17(3)4)8-9-16-15/h5-7,13,15-16H,8-10H2,1-4H3
InChIKeyIRBINIXXUDKLNQ-UHFFFAOYSA-N
XLogP2.66
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 ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylphenyl)-N,N-dimethylpiperidin-4-amine?
The IUPAC name of 2-(2,3-dimethylphenyl)-N,N-dimethylpiperidin-4-amine (CID 117000312) is 2-(2,3-dimethylphenyl)-N,N-dimethylpiperidin-4-amine.
What is the SMILES notation for 2-(2,3-dimethylphenyl)-N,N-dimethylpiperidin-4-amine?
The canonical SMILES for 2-(2,3-dimethylphenyl)-N,N-dimethylpiperidin-4-amine is Cc1cccc(C2CC(N(C)C)CCN2)c1C.
What is the InChIKey of 2-(2,3-dimethylphenyl)-N,N-dimethylpiperidin-4-amine?
The InChIKey is IRBINIXXUDKLNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-11-6-5-7-14(12(11)2)15-10-13(17(3)4)8-9-16-15/h5-7,13,15-16H,8-10H2,1-4H3.
What are the key properties of 2-(2,3-dimethylphenyl)-N,N-dimethylpiperidin-4-amine?
2-(2,3-dimethylphenyl)-N,N-dimethylpiperidin-4-amine has a molecular weight of 232.37 g/mol, XLogP of 2.66, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylphenyl)-N,N-dimethylpiperidin-4-amine is sourced from PubChem (CID 117000312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).