6-[2-[methyl-(1-methylpiperidin-4-yl)amino]ethyl]pyridin-3-amine

C14H24N4 — CID 107339981

IUPAC6-[2-[methyl-(1-methylpiperidin-4-yl)amino]ethyl]pyridin-3-amine
SMILESCN1CCC(N(C)CCc2ccc(N)cn2)CC1
InChIInChI=1S/C14H24N4/c1-17-8-6-14(7-9-17)18(2)10-5-13-4-3-12(15)11-16-13/h3-4,11,14H,5-10,15H2,1-2H3
InChIKeyHEDXWTDFHZELKP-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.23
Rot. Bonds4

About 6-[2-[methyl-(1-methylpiperidin-4-yl)amino]ethyl]pyridin-3-amine

6-[2-[methyl-(1-methylpiperidin-4-yl)amino]ethyl]pyridin-3-amine (PubChem CID 107339981) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 6-[2-[methyl-(1-methylpiperidin-4-yl)amino]ethyl]pyridin-3-amine.

Molecular Properties

Compound Name6-[2-[methyl-(1-methylpiperidin-4-yl)amino]ethyl]pyridin-3-amine
PubChem CID107339981
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name6-[2-[methyl-(1-methylpiperidin-4-yl)amino]ethyl]pyridin-3-amine
SMILESCN1CCC(N(C)CCc2ccc(N)cn2)CC1
InChIInChI=1S/C14H24N4/c1-17-8-6-14(7-9-17)18(2)10-5-13-4-3-12(15)11-16-13/h3-4,11,14H,5-10,15H2,1-2H3
InChIKeyHEDXWTDFHZELKP-UHFFFAOYSA-N
XLogP1.23
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[2-[methyl-(1-methylpiperidin-4-yl)amino]ethyl]pyridin-3-amine?
The IUPAC name of 6-[2-[methyl-(1-methylpiperidin-4-yl)amino]ethyl]pyridin-3-amine (CID 107339981) is 6-[2-[methyl-(1-methylpiperidin-4-yl)amino]ethyl]pyridin-3-amine.
What is the SMILES notation for 6-[2-[methyl-(1-methylpiperidin-4-yl)amino]ethyl]pyridin-3-amine?
The canonical SMILES for 6-[2-[methyl-(1-methylpiperidin-4-yl)amino]ethyl]pyridin-3-amine is CN1CCC(N(C)CCc2ccc(N)cn2)CC1.
What is the InChIKey of 6-[2-[methyl-(1-methylpiperidin-4-yl)amino]ethyl]pyridin-3-amine?
The InChIKey is HEDXWTDFHZELKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-17-8-6-14(7-9-17)18(2)10-5-13-4-3-12(15)11-16-13/h3-4,11,14H,5-10,15H2,1-2H3.
What are the key properties of 6-[2-[methyl-(1-methylpiperidin-4-yl)amino]ethyl]pyridin-3-amine?
6-[2-[methyl-(1-methylpiperidin-4-yl)amino]ethyl]pyridin-3-amine has a molecular weight of 248.37 g/mol, XLogP of 1.23, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-[methyl-(1-methylpiperidin-4-yl)amino]ethyl]pyridin-3-amine is sourced from PubChem (CID 107339981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).