N-methyl-N-[[6-[[methyl(pyridin-4-ylmethyl)amino]methyl]-2-pyridinyl]methyl]-1-pyridin-4-ylmethanamine

C21H25N5 — CID 137379420

IUPACN-methyl-N-[[6-[[methyl(pyridin-4-ylmethyl)amino]methyl]-2-pyridinyl]methyl]-1-pyridin-4-ylmethanamine
SMILESCN(Cc1ccncc1)Cc1cccc(CN(C)Cc2ccncc2)n1
InChIInChI=1S/C21H25N5/c1-25(14-18-6-10-22-11-7-18)16-20-4-3-5-21(24-20)17-26(2)15-19-8-12-23-13-9-19/h3-13H,14-17H2,1-2H3
InChIKeyFUMKFSYXXNIKIW-UHFFFAOYSA-N
MW347.47 g/mol
LogP3.14
Rot. Bonds8

About N-methyl-N-[[6-[[methyl(pyridin-4-ylmethyl)amino]methyl]-2-pyridinyl]methyl]-1-pyridin-4-ylmethanamine

N-methyl-N-[[6-[[methyl(pyridin-4-ylmethyl)amino]methyl]-2-pyridinyl]methyl]-1-pyridin-4-ylmethanamine (PubChem CID 137379420) has the molecular formula C21H25N5 and a molecular weight of 347.47 g/mol. Its IUPAC name is N-methyl-N-[[6-[[methyl(pyridin-4-ylmethyl)amino]methyl]-2-pyridinyl]methyl]-1-pyridin-4-ylmethanamine.

Molecular Properties

Compound NameN-methyl-N-[[6-[[methyl(pyridin-4-ylmethyl)amino]methyl]-2-pyridinyl]methyl]-1-pyridin-4-ylmethanamine
PubChem CID137379420
Molecular FormulaC21H25N5
Molecular Weight347.47 g/mol
Exact Mass347.21
IUPAC NameN-methyl-N-[[6-[[methyl(pyridin-4-ylmethyl)amino]methyl]-2-pyridinyl]methyl]-1-pyridin-4-ylmethanamine
SMILESCN(Cc1ccncc1)Cc1cccc(CN(C)Cc2ccncc2)n1
InChIInChI=1S/C21H25N5/c1-25(14-18-6-10-22-11-7-18)16-20-4-3-5-21(24-20)17-26(2)15-19-8-12-23-13-9-19/h3-13H,14-17H2,1-2H3
InChIKeyFUMKFSYXXNIKIW-UHFFFAOYSA-N
XLogP3.14
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.47
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-methyl-N-[[6-[[methyl(pyridin-4-ylmethyl)amino]methyl]-2-pyridinyl]methyl]-1-pyridin-4-ylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[[methyl(pyridin-4-ylmethyl)amino]methyl]pyridine-2-carbohydrazide
CID 106909075
[6-[[(4-fluorophenyl)methyl-methylamino]methyl]-2-pyridinyl]methanamine
CID 106905327
N-[(6-bromo-2-pyridinyl)methyl]-N-methyl-1-phenylmethanamine
CID 130604297
N-(chloromethyl)-N-methyl-1-pyridin-4-ylmethanamine
CID 115263261
N-[[6-[[(4-fluorophenyl)methyl-methylamino]methyl]-2-pyridinyl]methyl]ethanamine
CID 106905328
1-(4-fluorophenyl)-N-[(6-hydrazinyl-2-pyridinyl)methyl]-N-methylmethanamine
CID 79243570
2-methyl-3-[[methyl(pyridin-4-ylmethyl)amino]methyl]aniline
CID 43563884
2-[[methyl(pyridin-4-ylmethyl)amino]methyl]aniline
CID 43458561
4-[[methyl(pyridin-4-ylmethyl)amino]methyl]-1,3-thiazole-2-carboxylic acid
CID 43664654
6-[[ethyl(pyridin-4-ylmethyl)amino]methyl]pyridin-2-amine
CID 79242738
6-[[(4-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine
CID 79243754
N-[[3-[[methyl(pyridin-4-ylmethyl)amino]methyl]phenyl]methyl]ethanamine
CID 62432377

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[6-[[methyl(pyridin-4-ylmethyl)amino]methyl]-2-pyridinyl]methyl]-1-pyridin-4-ylmethanamine?
The IUPAC name of N-methyl-N-[[6-[[methyl(pyridin-4-ylmethyl)amino]methyl]-2-pyridinyl]methyl]-1-pyridin-4-ylmethanamine (CID 137379420) is N-methyl-N-[[6-[[methyl(pyridin-4-ylmethyl)amino]methyl]-2-pyridinyl]methyl]-1-pyridin-4-ylmethanamine.
What is the SMILES notation for N-methyl-N-[[6-[[methyl(pyridin-4-ylmethyl)amino]methyl]-2-pyridinyl]methyl]-1-pyridin-4-ylmethanamine?
The canonical SMILES for N-methyl-N-[[6-[[methyl(pyridin-4-ylmethyl)amino]methyl]-2-pyridinyl]methyl]-1-pyridin-4-ylmethanamine is CN(Cc1ccncc1)Cc1cccc(CN(C)Cc2ccncc2)n1.
What is the InChIKey of N-methyl-N-[[6-[[methyl(pyridin-4-ylmethyl)amino]methyl]-2-pyridinyl]methyl]-1-pyridin-4-ylmethanamine?
The InChIKey is FUMKFSYXXNIKIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N5/c1-25(14-18-6-10-22-11-7-18)16-20-4-3-5-21(24-20)17-26(2)15-19-8-12-23-13-9-19/h3-13H,14-17H2,1-2H3.
What are the key properties of N-methyl-N-[[6-[[methyl(pyridin-4-ylmethyl)amino]methyl]-2-pyridinyl]methyl]-1-pyridin-4-ylmethanamine?
N-methyl-N-[[6-[[methyl(pyridin-4-ylmethyl)amino]methyl]-2-pyridinyl]methyl]-1-pyridin-4-ylmethanamine has a molecular weight of 347.47 g/mol, XLogP of 3.14, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[6-[[methyl(pyridin-4-ylmethyl)amino]methyl]-2-pyridinyl]methyl]-1-pyridin-4-ylmethanamine is sourced from PubChem (CID 137379420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).