N-(pyridin-2-ylmethyl)-1-[6-[(pyridin-2-ylmethylamino)methyl]-2-pyridinyl]methanamine

C19H21N5 — CID 564837

IUPACN-(pyridin-2-ylmethyl)-1-[6-[(pyridin-2-ylmethylamino)methyl]-2-pyridinyl]methanamine
SMILESc1ccc(CNCc2cccc(CNCc3ccccn3)n2)nc1
InChIInChI=1S/C19H21N5/c1-3-10-22-16(6-1)12-20-14-18-8-5-9-19(24-18)15-21-13-17-7-2-4-11-23-17/h1-11,20-21H,12-15H2
InChIKeyVRZWHBILVSDZSL-UHFFFAOYSA-N
MW319.41 g/mol
LogP2.45
Rot. Bonds8

About N-(pyridin-2-ylmethyl)-1-[6-[(pyridin-2-ylmethylamino)methyl]-2-pyridinyl]methanamine

N-(pyridin-2-ylmethyl)-1-[6-[(pyridin-2-ylmethylamino)methyl]-2-pyridinyl]methanamine (PubChem CID 564837) has the molecular formula C19H21N5 and a molecular weight of 319.41 g/mol. Its IUPAC name is N-(pyridin-2-ylmethyl)-1-[6-[(pyridin-2-ylmethylamino)methyl]-2-pyridinyl]methanamine.

Molecular Properties

Compound NameN-(pyridin-2-ylmethyl)-1-[6-[(pyridin-2-ylmethylamino)methyl]-2-pyridinyl]methanamine
PubChem CID564837
Molecular FormulaC19H21N5
Molecular Weight319.41 g/mol
Exact Mass319.18
IUPAC NameN-(pyridin-2-ylmethyl)-1-[6-[(pyridin-2-ylmethylamino)methyl]-2-pyridinyl]methanamine
SMILESc1ccc(CNCc2cccc(CNCc3ccccn3)n2)nc1
InChIInChI=1S/C19H21N5/c1-3-10-22-16(6-1)12-20-14-18-8-5-9-19(24-18)15-21-13-17-7-2-4-11-23-17/h1-11,20-21H,12-15H2
InChIKeyVRZWHBILVSDZSL-UHFFFAOYSA-N
XLogP2.45
TPSA62.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(pyridin-2-ylmethyl)-1-[6-[(pyridin-2-ylmethylamino)methyl]-2-pyridinyl]methanamine 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

N-[(6-methyl-2-pyridinyl)methyl]-1-pyridin-2-ylmethanamine
CID 15900109
zinc;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;dihydrochloride
CID 73345757
1-naphthalen-1-yl-N-(pyridin-2-ylmethyl)methanamine
CID 935553
N'-(pyridin-2-ylmethyl)-N-[2-(pyridin-2-ylmethylamino)ethyl]ethane-1,2-diamine
CID 12029921
1-(2-fluorophenyl)-N-(pyridin-2-ylmethyl)methanamine
CID 1085208
azane;methane;[4-[(pyridin-2-ylmethylamino)methyl]phenyl]methanamine
CID 158212763
N-[[6-[(benzylamino)methyl]-2-pyridinyl]methyl]-1-phenylmethanamine
CID 11639693
1-(2-methylphenyl)-N-(pyridin-2-ylmethyl)methanamine
CID 2759812
1-(3-chlorophenyl)-N-(pyridin-2-ylmethyl)methanamine
CID 4719779
N-benzyl-N'-(pyridin-2-ylmethyl)ethane-1,2-diamine
CID 90740224
1-(4-methylphenyl)-N-(pyridin-2-ylmethyl)methanamine;hydrochloride
CID 44782427
2-bromo-6-[(pyridin-2-ylmethylamino)methyl]phenol
CID 61389966

Frequently Asked Questions

What is the IUPAC name of N-(pyridin-2-ylmethyl)-1-[6-[(pyridin-2-ylmethylamino)methyl]-2-pyridinyl]methanamine?
The IUPAC name of N-(pyridin-2-ylmethyl)-1-[6-[(pyridin-2-ylmethylamino)methyl]-2-pyridinyl]methanamine (CID 564837) is N-(pyridin-2-ylmethyl)-1-[6-[(pyridin-2-ylmethylamino)methyl]-2-pyridinyl]methanamine.
What is the SMILES notation for N-(pyridin-2-ylmethyl)-1-[6-[(pyridin-2-ylmethylamino)methyl]-2-pyridinyl]methanamine?
The canonical SMILES for N-(pyridin-2-ylmethyl)-1-[6-[(pyridin-2-ylmethylamino)methyl]-2-pyridinyl]methanamine is c1ccc(CNCc2cccc(CNCc3ccccn3)n2)nc1.
What is the InChIKey of N-(pyridin-2-ylmethyl)-1-[6-[(pyridin-2-ylmethylamino)methyl]-2-pyridinyl]methanamine?
The InChIKey is VRZWHBILVSDZSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5/c1-3-10-22-16(6-1)12-20-14-18-8-5-9-19(24-18)15-21-13-17-7-2-4-11-23-17/h1-11,20-21H,12-15H2.
What are the key properties of N-(pyridin-2-ylmethyl)-1-[6-[(pyridin-2-ylmethylamino)methyl]-2-pyridinyl]methanamine?
N-(pyridin-2-ylmethyl)-1-[6-[(pyridin-2-ylmethylamino)methyl]-2-pyridinyl]methanamine has a molecular weight of 319.41 g/mol, XLogP of 2.45, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyridin-2-ylmethyl)-1-[6-[(pyridin-2-ylmethylamino)methyl]-2-pyridinyl]methanamine is sourced from PubChem (CID 564837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).