1-(2,4-dimethylpiperidin-1-yl)-1-pyridin-4-ylpropan-2-amine

C15H25N3 — CID 62332274

IUPAC1-(2,4-dimethylpiperidin-1-yl)-1-pyridin-4-ylpropan-2-amine
SMILESCC1CCN(C(c2ccncc2)C(C)N)C(C)C1
InChIInChI=1S/C15H25N3/c1-11-6-9-18(12(2)10-11)15(13(3)16)14-4-7-17-8-5-14/h4-5,7-8,11-13,15H,6,9-10,16H2,1-3H3
InChIKeyUJJDEZLBMOUKEM-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.59
Rot. Bonds3

About 1-(2,4-dimethylpiperidin-1-yl)-1-pyridin-4-ylpropan-2-amine

1-(2,4-dimethylpiperidin-1-yl)-1-pyridin-4-ylpropan-2-amine (PubChem CID 62332274) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 1-(2,4-dimethylpiperidin-1-yl)-1-pyridin-4-ylpropan-2-amine.

Molecular Properties

Compound Name1-(2,4-dimethylpiperidin-1-yl)-1-pyridin-4-ylpropan-2-amine
PubChem CID62332274
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name1-(2,4-dimethylpiperidin-1-yl)-1-pyridin-4-ylpropan-2-amine
SMILESCC1CCN(C(c2ccncc2)C(C)N)C(C)C1
InChIInChI=1S/C15H25N3/c1-11-6-9-18(12(2)10-11)15(13(3)16)14-4-7-17-8-5-14/h4-5,7-8,11-13,15H,6,9-10,16H2,1-3H3
InChIKeyUJJDEZLBMOUKEM-UHFFFAOYSA-N
XLogP2.59
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethylpiperidin-1-yl)-1-pyridin-4-ylpropan-2-amine?
The IUPAC name of 1-(2,4-dimethylpiperidin-1-yl)-1-pyridin-4-ylpropan-2-amine (CID 62332274) is 1-(2,4-dimethylpiperidin-1-yl)-1-pyridin-4-ylpropan-2-amine.
What is the SMILES notation for 1-(2,4-dimethylpiperidin-1-yl)-1-pyridin-4-ylpropan-2-amine?
The canonical SMILES for 1-(2,4-dimethylpiperidin-1-yl)-1-pyridin-4-ylpropan-2-amine is CC1CCN(C(c2ccncc2)C(C)N)C(C)C1.
What is the InChIKey of 1-(2,4-dimethylpiperidin-1-yl)-1-pyridin-4-ylpropan-2-amine?
The InChIKey is UJJDEZLBMOUKEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-11-6-9-18(12(2)10-11)15(13(3)16)14-4-7-17-8-5-14/h4-5,7-8,11-13,15H,6,9-10,16H2,1-3H3.
What are the key properties of 1-(2,4-dimethylpiperidin-1-yl)-1-pyridin-4-ylpropan-2-amine?
1-(2,4-dimethylpiperidin-1-yl)-1-pyridin-4-ylpropan-2-amine has a molecular weight of 247.39 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethylpiperidin-1-yl)-1-pyridin-4-ylpropan-2-amine is sourced from PubChem (CID 62332274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).