1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine

C12H19N3 — CID 11160034

IUPAC1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine
SMILESCc1cccc(CN2CCCC(N)C2)n1
InChIInChI=1S/C12H19N3/c1-10-4-2-6-12(14-10)9-15-7-3-5-11(13)8-15/h2,4,6,11H,3,5,7-9,13H2,1H3
InChIKeyJXYZAEMNUWXULO-UHFFFAOYSA-N
MW205.31 g/mol
LogP1.31
Rot. Bonds2

About 1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine

1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine (PubChem CID 11160034) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is 1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine.

Molecular Properties

Compound Name1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine
PubChem CID11160034
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine
SMILESCc1cccc(CN2CCCC(N)C2)n1
InChIInChI=1S/C12H19N3/c1-10-4-2-6-12(14-10)9-15-7-3-5-11(13)8-15/h2,4,6,11H,3,5,7-9,13H2,1H3
InChIKeyJXYZAEMNUWXULO-UHFFFAOYSA-N
XLogP1.31
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine?
The IUPAC name of 1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine (CID 11160034) is 1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine.
What is the SMILES notation for 1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine?
The canonical SMILES for 1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine is Cc1cccc(CN2CCCC(N)C2)n1.
What is the InChIKey of 1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine?
The InChIKey is JXYZAEMNUWXULO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-10-4-2-6-12(14-10)9-15-7-3-5-11(13)8-15/h2,4,6,11H,3,5,7-9,13H2,1H3.
What are the key properties of 1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine?
1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine has a molecular weight of 205.31 g/mol, XLogP of 1.31, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine is sourced from PubChem (CID 11160034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).