[6-(2,4-dimethylpiperidin-1-yl)-3-pyridinyl]methanamine

C13H21N3 — CID 62344994

IUPAC[6-(2,4-dimethylpiperidin-1-yl)-3-pyridinyl]methanamine
SMILESCC1CCN(c2ccc(CN)cn2)C(C)C1
InChIInChI=1S/C13H21N3/c1-10-5-6-16(11(2)7-10)13-4-3-12(8-14)9-15-13/h3-4,9-11H,5-8,14H2,1-2H3
InChIKeyWFHJVANNXOPTQU-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.17
Rot. Bonds2

About [6-(2,4-dimethylpiperidin-1-yl)-3-pyridinyl]methanamine

[6-(2,4-dimethylpiperidin-1-yl)-3-pyridinyl]methanamine (PubChem CID 62344994) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is [6-(2,4-dimethylpiperidin-1-yl)-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-(2,4-dimethylpiperidin-1-yl)-3-pyridinyl]methanamine
PubChem CID62344994
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name[6-(2,4-dimethylpiperidin-1-yl)-3-pyridinyl]methanamine
SMILESCC1CCN(c2ccc(CN)cn2)C(C)C1
InChIInChI=1S/C13H21N3/c1-10-5-6-16(11(2)7-10)13-4-3-12(8-14)9-15-13/h3-4,9-11H,5-8,14H2,1-2H3
InChIKeyWFHJVANNXOPTQU-UHFFFAOYSA-N
XLogP2.17
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 ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [6-(2,4-dimethylpiperidin-1-yl)-3-pyridinyl]methanamine?
The IUPAC name of [6-(2,4-dimethylpiperidin-1-yl)-3-pyridinyl]methanamine (CID 62344994) is [6-(2,4-dimethylpiperidin-1-yl)-3-pyridinyl]methanamine.
What is the SMILES notation for [6-(2,4-dimethylpiperidin-1-yl)-3-pyridinyl]methanamine?
The canonical SMILES for [6-(2,4-dimethylpiperidin-1-yl)-3-pyridinyl]methanamine is CC1CCN(c2ccc(CN)cn2)C(C)C1.
What is the InChIKey of [6-(2,4-dimethylpiperidin-1-yl)-3-pyridinyl]methanamine?
The InChIKey is WFHJVANNXOPTQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-10-5-6-16(11(2)7-10)13-4-3-12(8-14)9-15-13/h3-4,9-11H,5-8,14H2,1-2H3.
What are the key properties of [6-(2,4-dimethylpiperidin-1-yl)-3-pyridinyl]methanamine?
[6-(2,4-dimethylpiperidin-1-yl)-3-pyridinyl]methanamine has a molecular weight of 219.33 g/mol, XLogP of 2.17, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2,4-dimethylpiperidin-1-yl)-3-pyridinyl]methanamine is sourced from PubChem (CID 62344994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).