6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-2-amine

C13H21N3 — CID 18771836

IUPAC6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-2-amine
SMILESCC1CC(C)CN(Cc2cccc(N)n2)C1
InChIInChI=1S/C13H21N3/c1-10-6-11(2)8-16(7-10)9-12-4-3-5-13(14)15-12/h3-5,10-11H,6-9H2,1-2H3,(H2,14,15)
InChIKeyXFPYFIFXIVJALS-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.14
Rot. Bonds2

About 6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-2-amine

6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-2-amine (PubChem CID 18771836) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-2-amine
PubChem CID18771836
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-2-amine
SMILESCC1CC(C)CN(Cc2cccc(N)n2)C1
InChIInChI=1S/C13H21N3/c1-10-6-11(2)8-16(7-10)9-12-4-3-5-13(14)15-12/h3-5,10-11H,6-9H2,1-2H3,(H2,14,15)
InChIKeyXFPYFIFXIVJALS-UHFFFAOYSA-N
XLogP2.14
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-2-amine?
The IUPAC name of 6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-2-amine (CID 18771836) is 6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-2-amine.
What is the SMILES notation for 6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-2-amine?
The canonical SMILES for 6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-2-amine is CC1CC(C)CN(Cc2cccc(N)n2)C1.
What is the InChIKey of 6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-2-amine?
The InChIKey is XFPYFIFXIVJALS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-10-6-11(2)8-16(7-10)9-12-4-3-5-13(14)15-12/h3-5,10-11H,6-9H2,1-2H3,(H2,14,15).
What are the key properties of 6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-2-amine?
6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-2-amine has a molecular weight of 219.33 g/mol, XLogP of 2.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 18771836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).