N-methyl-1-(2-methyl-3-pyridinyl)-1-(5-methyl-3-pyridinyl)methanamine

C14H17N3 — CID 105173794

IUPACN-methyl-1-(2-methyl-3-pyridinyl)-1-(5-methyl-3-pyridinyl)methanamine
SMILESCNC(c1cncc(C)c1)c1cccnc1C
InChIInChI=1S/C14H17N3/c1-10-7-12(9-16-8-10)14(15-3)13-5-4-6-17-11(13)2/h4-9,14-15H,1-3H3
InChIKeyOETPDBNTGMRUEK-UHFFFAOYSA-N
MW227.31 g/mol
LogP2.40
Rot. Bonds3

About N-methyl-1-(2-methyl-3-pyridinyl)-1-(5-methyl-3-pyridinyl)methanamine

N-methyl-1-(2-methyl-3-pyridinyl)-1-(5-methyl-3-pyridinyl)methanamine (PubChem CID 105173794) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is N-methyl-1-(2-methyl-3-pyridinyl)-1-(5-methyl-3-pyridinyl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(2-methyl-3-pyridinyl)-1-(5-methyl-3-pyridinyl)methanamine
PubChem CID105173794
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC NameN-methyl-1-(2-methyl-3-pyridinyl)-1-(5-methyl-3-pyridinyl)methanamine
SMILESCNC(c1cncc(C)c1)c1cccnc1C
InChIInChI=1S/C14H17N3/c1-10-7-12(9-16-8-10)14(15-3)13-5-4-6-17-11(13)2/h4-9,14-15H,1-3H3
InChIKeyOETPDBNTGMRUEK-UHFFFAOYSA-N
XLogP2.40
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methyl-3-pyridinyl)-1-(5-methyl-3-pyridinyl)methanamine?
The IUPAC name of N-methyl-1-(2-methyl-3-pyridinyl)-1-(5-methyl-3-pyridinyl)methanamine (CID 105173794) is N-methyl-1-(2-methyl-3-pyridinyl)-1-(5-methyl-3-pyridinyl)methanamine.
What is the SMILES notation for N-methyl-1-(2-methyl-3-pyridinyl)-1-(5-methyl-3-pyridinyl)methanamine?
The canonical SMILES for N-methyl-1-(2-methyl-3-pyridinyl)-1-(5-methyl-3-pyridinyl)methanamine is CNC(c1cncc(C)c1)c1cccnc1C.
What is the InChIKey of N-methyl-1-(2-methyl-3-pyridinyl)-1-(5-methyl-3-pyridinyl)methanamine?
The InChIKey is OETPDBNTGMRUEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-10-7-12(9-16-8-10)14(15-3)13-5-4-6-17-11(13)2/h4-9,14-15H,1-3H3.
What are the key properties of N-methyl-1-(2-methyl-3-pyridinyl)-1-(5-methyl-3-pyridinyl)methanamine?
N-methyl-1-(2-methyl-3-pyridinyl)-1-(5-methyl-3-pyridinyl)methanamine has a molecular weight of 227.31 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methyl-3-pyridinyl)-1-(5-methyl-3-pyridinyl)methanamine is sourced from PubChem (CID 105173794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).