N-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-amine

C12H19N3 — CID 62547429

IUPACN-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-amine
SMILESCNC1CCCN(c2cc(C)ccn2)C1
InChIInChI=1S/C12H19N3/c1-10-5-6-14-12(8-10)15-7-3-4-11(9-15)13-2/h5-6,8,11,13H,3-4,7,9H2,1-2H3
InChIKeyLDOGWFUWTBQZRD-UHFFFAOYSA-N
MW205.31 g/mol
LogP1.58
Rot. Bonds2

About N-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-amine

N-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-amine (PubChem CID 62547429) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is N-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-amine.

Molecular Properties

Compound NameN-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-amine
PubChem CID62547429
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC NameN-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-amine
SMILESCNC1CCCN(c2cc(C)ccn2)C1
InChIInChI=1S/C12H19N3/c1-10-5-6-14-12(8-10)15-7-3-4-11(9-15)13-2/h5-6,8,11,13H,3-4,7,9H2,1-2H3
InChIKeyLDOGWFUWTBQZRD-UHFFFAOYSA-N
XLogP1.58
TPSA28.16 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 ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-amine?
The IUPAC name of N-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-amine (CID 62547429) is N-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-amine.
What is the SMILES notation for N-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-amine?
The canonical SMILES for N-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-amine is CNC1CCCN(c2cc(C)ccn2)C1.
What is the InChIKey of N-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-amine?
The InChIKey is LDOGWFUWTBQZRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-10-5-6-14-12(8-10)15-7-3-4-11(9-15)13-2/h5-6,8,11,13H,3-4,7,9H2,1-2H3.
What are the key properties of N-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-amine?
N-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-amine has a molecular weight of 205.31 g/mol, XLogP of 1.58, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(4-methyl-2-pyridinyl)piperidin-3-amine is sourced from PubChem (CID 62547429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).