1-methyl-N-(2-pyridin-4-ylethyl)piperidin-4-amine

C13H21N3 — CID 60864534

IUPAC1-methyl-N-(2-pyridin-4-ylethyl)piperidin-4-amine
SMILESCN1CCC(NCCc2ccncc2)CC1
InChIInChI=1S/C13H21N3/c1-16-10-5-13(6-11-16)15-9-4-12-2-7-14-8-3-12/h2-3,7-8,13,15H,4-6,9-11H2,1H3
InChIKeyGQWYKTURFIGKEM-UHFFFAOYSA-N
MW219.33 g/mol
LogP1.31
Rot. Bonds4

About 1-methyl-N-(2-pyridin-4-ylethyl)piperidin-4-amine

1-methyl-N-(2-pyridin-4-ylethyl)piperidin-4-amine (PubChem CID 60864534) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-methyl-N-(2-pyridin-4-ylethyl)piperidin-4-amine.

Molecular Properties

Compound Name1-methyl-N-(2-pyridin-4-ylethyl)piperidin-4-amine
PubChem CID60864534
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name1-methyl-N-(2-pyridin-4-ylethyl)piperidin-4-amine
SMILESCN1CCC(NCCc2ccncc2)CC1
InChIInChI=1S/C13H21N3/c1-16-10-5-13(6-11-16)15-9-4-12-2-7-14-8-3-12/h2-3,7-8,13,15H,4-6,9-11H2,1H3
InChIKeyGQWYKTURFIGKEM-UHFFFAOYSA-N
XLogP1.31
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
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-methyl-N-(2-pyridin-4-ylethyl)piperidin-4-amine?
The IUPAC name of 1-methyl-N-(2-pyridin-4-ylethyl)piperidin-4-amine (CID 60864534) is 1-methyl-N-(2-pyridin-4-ylethyl)piperidin-4-amine.
What is the SMILES notation for 1-methyl-N-(2-pyridin-4-ylethyl)piperidin-4-amine?
The canonical SMILES for 1-methyl-N-(2-pyridin-4-ylethyl)piperidin-4-amine is CN1CCC(NCCc2ccncc2)CC1.
What is the InChIKey of 1-methyl-N-(2-pyridin-4-ylethyl)piperidin-4-amine?
The InChIKey is GQWYKTURFIGKEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-16-10-5-13(6-11-16)15-9-4-12-2-7-14-8-3-12/h2-3,7-8,13,15H,4-6,9-11H2,1H3.
What are the key properties of 1-methyl-N-(2-pyridin-4-ylethyl)piperidin-4-amine?
1-methyl-N-(2-pyridin-4-ylethyl)piperidin-4-amine has a molecular weight of 219.33 g/mol, XLogP of 1.31, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(2-pyridin-4-ylethyl)piperidin-4-amine is sourced from PubChem (CID 60864534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).