2,2-dimethyl-1-(2-methylphenyl)piperidin-4-amine

C14H22N2 — CID 117020100

IUPAC2,2-dimethyl-1-(2-methylphenyl)piperidin-4-amine
SMILESCc1ccccc1N1CCC(N)CC1(C)C
InChIInChI=1S/C14H22N2/c1-11-6-4-5-7-13(11)16-9-8-12(15)10-14(16,2)3/h4-7,12H,8-10,15H2,1-3H3
InChIKeyAATUCNVAVKIXLR-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.70
Rot. Bonds1

About 2,2-dimethyl-1-(2-methylphenyl)piperidin-4-amine

2,2-dimethyl-1-(2-methylphenyl)piperidin-4-amine (PubChem CID 117020100) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 2,2-dimethyl-1-(2-methylphenyl)piperidin-4-amine.

Molecular Properties

Compound Name2,2-dimethyl-1-(2-methylphenyl)piperidin-4-amine
PubChem CID117020100
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name2,2-dimethyl-1-(2-methylphenyl)piperidin-4-amine
SMILESCc1ccccc1N1CCC(N)CC1(C)C
InChIInChI=1S/C14H22N2/c1-11-6-4-5-7-13(11)16-9-8-12(15)10-14(16,2)3/h4-7,12H,8-10,15H2,1-3H3
InChIKeyAATUCNVAVKIXLR-UHFFFAOYSA-N
XLogP2.70
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-1-(2-methylphenyl)piperidin-4-amine?
The IUPAC name of 2,2-dimethyl-1-(2-methylphenyl)piperidin-4-amine (CID 117020100) is 2,2-dimethyl-1-(2-methylphenyl)piperidin-4-amine.
What is the SMILES notation for 2,2-dimethyl-1-(2-methylphenyl)piperidin-4-amine?
The canonical SMILES for 2,2-dimethyl-1-(2-methylphenyl)piperidin-4-amine is Cc1ccccc1N1CCC(N)CC1(C)C.
What is the InChIKey of 2,2-dimethyl-1-(2-methylphenyl)piperidin-4-amine?
The InChIKey is AATUCNVAVKIXLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-11-6-4-5-7-13(11)16-9-8-12(15)10-14(16,2)3/h4-7,12H,8-10,15H2,1-3H3.
What are the key properties of 2,2-dimethyl-1-(2-methylphenyl)piperidin-4-amine?
2,2-dimethyl-1-(2-methylphenyl)piperidin-4-amine has a molecular weight of 218.34 g/mol, XLogP of 2.70, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1-(2-methylphenyl)piperidin-4-amine is sourced from PubChem (CID 117020100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).