[2-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]methanamine

C15H24N2 — CID 15121448

IUPAC[2-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]methanamine
SMILESCC1CCCC(C)N1Cc1ccccc1CN
InChIInChI=1S/C15H24N2/c1-12-6-5-7-13(2)17(12)11-15-9-4-3-8-14(15)10-16/h3-4,8-9,12-13H,5-7,10-11,16H2,1-2H3
InChIKeyYKLGOIXNKXXNKX-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.91
Rot. Bonds3

About [2-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]methanamine

[2-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]methanamine (PubChem CID 15121448) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is [2-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]methanamine.

Molecular Properties

Compound Name[2-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]methanamine
PubChem CID15121448
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name[2-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]methanamine
SMILESCC1CCCC(C)N1Cc1ccccc1CN
InChIInChI=1S/C15H24N2/c1-12-6-5-7-13(2)17(12)11-15-9-4-3-8-14(15)10-16/h3-4,8-9,12-13H,5-7,10-11,16H2,1-2H3
InChIKeyYKLGOIXNKXXNKX-UHFFFAOYSA-N
XLogP2.91
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]methanamine?
The IUPAC name of [2-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]methanamine (CID 15121448) is [2-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]methanamine.
What is the SMILES notation for [2-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]methanamine?
The canonical SMILES for [2-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]methanamine is CC1CCCC(C)N1Cc1ccccc1CN.
What is the InChIKey of [2-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]methanamine?
The InChIKey is YKLGOIXNKXXNKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-12-6-5-7-13(2)17(12)11-15-9-4-3-8-14(15)10-16/h3-4,8-9,12-13H,5-7,10-11,16H2,1-2H3.
What are the key properties of [2-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]methanamine?
[2-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]methanamine has a molecular weight of 232.37 g/mol, XLogP of 2.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]methanamine is sourced from PubChem (CID 15121448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).