6-(aminomethyl)-N-methyl-N-(1-methylpiperidin-4-yl)pyridin-2-amine

C13H22N4 — CID 62299838

IUPAC6-(aminomethyl)-N-methyl-N-(1-methylpiperidin-4-yl)pyridin-2-amine
SMILESCN1CCC(N(C)c2cccc(CN)n2)CC1
InChIInChI=1S/C13H22N4/c1-16-8-6-12(7-9-16)17(2)13-5-3-4-11(10-14)15-13/h3-5,12H,6-10,14H2,1-2H3
InChIKeyLANXORVGODCACR-UHFFFAOYSA-N
MW234.35 g/mol
LogP1.07
Rot. Bonds3

About 6-(aminomethyl)-N-methyl-N-(1-methylpiperidin-4-yl)pyridin-2-amine

6-(aminomethyl)-N-methyl-N-(1-methylpiperidin-4-yl)pyridin-2-amine (PubChem CID 62299838) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is 6-(aminomethyl)-N-methyl-N-(1-methylpiperidin-4-yl)pyridin-2-amine.

Molecular Properties

Compound Name6-(aminomethyl)-N-methyl-N-(1-methylpiperidin-4-yl)pyridin-2-amine
PubChem CID62299838
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name6-(aminomethyl)-N-methyl-N-(1-methylpiperidin-4-yl)pyridin-2-amine
SMILESCN1CCC(N(C)c2cccc(CN)n2)CC1
InChIInChI=1S/C13H22N4/c1-16-8-6-12(7-9-16)17(2)13-5-3-4-11(10-14)15-13/h3-5,12H,6-10,14H2,1-2H3
InChIKeyLANXORVGODCACR-UHFFFAOYSA-N
XLogP1.07
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-N-methyl-N-(1-methylpiperidin-4-yl)pyridin-2-amine?
The IUPAC name of 6-(aminomethyl)-N-methyl-N-(1-methylpiperidin-4-yl)pyridin-2-amine (CID 62299838) is 6-(aminomethyl)-N-methyl-N-(1-methylpiperidin-4-yl)pyridin-2-amine.
What is the SMILES notation for 6-(aminomethyl)-N-methyl-N-(1-methylpiperidin-4-yl)pyridin-2-amine?
The canonical SMILES for 6-(aminomethyl)-N-methyl-N-(1-methylpiperidin-4-yl)pyridin-2-amine is CN1CCC(N(C)c2cccc(CN)n2)CC1.
What is the InChIKey of 6-(aminomethyl)-N-methyl-N-(1-methylpiperidin-4-yl)pyridin-2-amine?
The InChIKey is LANXORVGODCACR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-16-8-6-12(7-9-16)17(2)13-5-3-4-11(10-14)15-13/h3-5,12H,6-10,14H2,1-2H3.
What are the key properties of 6-(aminomethyl)-N-methyl-N-(1-methylpiperidin-4-yl)pyridin-2-amine?
6-(aminomethyl)-N-methyl-N-(1-methylpiperidin-4-yl)pyridin-2-amine has a molecular weight of 234.35 g/mol, XLogP of 1.07, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-N-methyl-N-(1-methylpiperidin-4-yl)pyridin-2-amine is sourced from PubChem (CID 62299838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).