N-methyl-1-(5-methyl-3-pyridinyl)-1-pyridin-3-ylmethanamine

C13H15N3 — CID 115374295

IUPACN-methyl-1-(5-methyl-3-pyridinyl)-1-pyridin-3-ylmethanamine
SMILESCNC(c1cccnc1)c1cncc(C)c1
InChIInChI=1S/C13H15N3/c1-10-6-12(9-16-7-10)13(14-2)11-4-3-5-15-8-11/h3-9,13-14H,1-2H3
InChIKeyLQDVZNJVBHLENP-UHFFFAOYSA-N
MW213.28 g/mol
LogP2.09
Rot. Bonds3

About N-methyl-1-(5-methyl-3-pyridinyl)-1-pyridin-3-ylmethanamine

N-methyl-1-(5-methyl-3-pyridinyl)-1-pyridin-3-ylmethanamine (PubChem CID 115374295) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is N-methyl-1-(5-methyl-3-pyridinyl)-1-pyridin-3-ylmethanamine.

Molecular Properties

Compound NameN-methyl-1-(5-methyl-3-pyridinyl)-1-pyridin-3-ylmethanamine
PubChem CID115374295
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC NameN-methyl-1-(5-methyl-3-pyridinyl)-1-pyridin-3-ylmethanamine
SMILESCNC(c1cccnc1)c1cncc(C)c1
InChIInChI=1S/C13H15N3/c1-10-6-12(9-16-7-10)13(14-2)11-4-3-5-15-8-11/h3-9,13-14H,1-2H3
InChIKeyLQDVZNJVBHLENP-UHFFFAOYSA-N
XLogP2.09
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-methyl-3-pyridinyl)-1-pyridin-3-ylmethanamine?
The IUPAC name of N-methyl-1-(5-methyl-3-pyridinyl)-1-pyridin-3-ylmethanamine (CID 115374295) is N-methyl-1-(5-methyl-3-pyridinyl)-1-pyridin-3-ylmethanamine.
What is the SMILES notation for N-methyl-1-(5-methyl-3-pyridinyl)-1-pyridin-3-ylmethanamine?
The canonical SMILES for N-methyl-1-(5-methyl-3-pyridinyl)-1-pyridin-3-ylmethanamine is CNC(c1cccnc1)c1cncc(C)c1.
What is the InChIKey of N-methyl-1-(5-methyl-3-pyridinyl)-1-pyridin-3-ylmethanamine?
The InChIKey is LQDVZNJVBHLENP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c1-10-6-12(9-16-7-10)13(14-2)11-4-3-5-15-8-11/h3-9,13-14H,1-2H3.
What are the key properties of N-methyl-1-(5-methyl-3-pyridinyl)-1-pyridin-3-ylmethanamine?
N-methyl-1-(5-methyl-3-pyridinyl)-1-pyridin-3-ylmethanamine has a molecular weight of 213.28 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5-methyl-3-pyridinyl)-1-pyridin-3-ylmethanamine is sourced from PubChem (CID 115374295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).