5-[3-[(6-pyridin-2-yl-3-pyridinyl)methylamino]propyl]pyridin-2-amine

C19H21N5 — CID 146148338

IUPAC5-[3-[(6-pyridin-2-yl-3-pyridinyl)methylamino]propyl]pyridin-2-amine
SMILESNc1ccc(CCCNCc2ccc(-c3ccccn3)nc2)cn1
InChIInChI=1S/C19H21N5/c20-19-9-7-15(13-24-19)4-3-10-21-12-16-6-8-18(23-14-16)17-5-1-2-11-22-17/h1-2,5-9,11,13-14,21H,3-4,10,12H2,(H2,20,24)
InChIKeyIZZRVYUDGDZJGH-UHFFFAOYSA-N
MW319.41 g/mol
LogP2.84
Rot. Bonds7

About 5-[3-[(6-pyridin-2-yl-3-pyridinyl)methylamino]propyl]pyridin-2-amine

5-[3-[(6-pyridin-2-yl-3-pyridinyl)methylamino]propyl]pyridin-2-amine (PubChem CID 146148338) has the molecular formula C19H21N5 and a molecular weight of 319.41 g/mol. Its IUPAC name is 5-[3-[(6-pyridin-2-yl-3-pyridinyl)methylamino]propyl]pyridin-2-amine.

Molecular Properties

Compound Name5-[3-[(6-pyridin-2-yl-3-pyridinyl)methylamino]propyl]pyridin-2-amine
PubChem CID146148338
Molecular FormulaC19H21N5
Molecular Weight319.41 g/mol
Exact Mass319.18
IUPAC Name5-[3-[(6-pyridin-2-yl-3-pyridinyl)methylamino]propyl]pyridin-2-amine
SMILESNc1ccc(CCCNCc2ccc(-c3ccccn3)nc2)cn1
InChIInChI=1S/C19H21N5/c20-19-9-7-15(13-24-19)4-3-10-21-12-16-6-8-18(23-14-16)17-5-1-2-11-22-17/h1-2,5-9,11,13-14,21H,3-4,10,12H2,(H2,20,24)
InChIKeyIZZRVYUDGDZJGH-UHFFFAOYSA-N
XLogP2.84
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 5-[3-[(6-pyridin-2-yl-3-pyridinyl)methylamino]propyl]pyridin-2-amine with MolForge

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Related Compounds

2-pyridin-2-yl-5-[2-(6-pyridin-2-yl-3-pyridinyl)ethyl]pyridine
CID 102191368
2-(2-propan-2-yl-1,3-benzoxazol-5-yl)-N-[(6-pyridin-2-yl-3-pyridinyl)methyl]ethanamine
CID 167811038
3-(6-pyridin-2-yl-3-pyridinyl)propanoic acid
CID 121355469
ethane;5-ethyl-2-pyridin-2-ylpyridine
CID 143067787
4-(6-pyridin-2-yl-3-pyridinyl)butyl prop-2-enoate
CID 11087244
CID 101437421
CID 101437421
2-phenoxy-N-[(6-pyridin-2-yl-3-pyridinyl)methyl]acetamide
CID 110714395
2-[[6-(6-pyridin-2-yl-1,2,4,5-tetrazin-3-yl)-3-pyridinyl]methylamino]acetic acid
CID 165114141
1-phenyl-N-[(6-pyridin-2-yl-3-pyridinyl)methyl]methanesulfonamide
CID 110714444
iridium(3+);2-phenyl-5-[6-(6-phenyl-3-pyridinyl)hexyl]pyridine;2-phenylpyridine
CID 155607489
2-(6-pyridin-2-yl-3-pyridinyl)acetonitrile
CID 121008779
5-(methoxymethyl)-2-pyridin-2-ylpyridine
CID 58454942

Frequently Asked Questions

What is the IUPAC name of 5-[3-[(6-pyridin-2-yl-3-pyridinyl)methylamino]propyl]pyridin-2-amine?
The IUPAC name of 5-[3-[(6-pyridin-2-yl-3-pyridinyl)methylamino]propyl]pyridin-2-amine (CID 146148338) is 5-[3-[(6-pyridin-2-yl-3-pyridinyl)methylamino]propyl]pyridin-2-amine.
What is the SMILES notation for 5-[3-[(6-pyridin-2-yl-3-pyridinyl)methylamino]propyl]pyridin-2-amine?
The canonical SMILES for 5-[3-[(6-pyridin-2-yl-3-pyridinyl)methylamino]propyl]pyridin-2-amine is Nc1ccc(CCCNCc2ccc(-c3ccccn3)nc2)cn1.
What is the InChIKey of 5-[3-[(6-pyridin-2-yl-3-pyridinyl)methylamino]propyl]pyridin-2-amine?
The InChIKey is IZZRVYUDGDZJGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5/c20-19-9-7-15(13-24-19)4-3-10-21-12-16-6-8-18(23-14-16)17-5-1-2-11-22-17/h1-2,5-9,11,13-14,21H,3-4,10,12H2,(H2,20,24).
What are the key properties of 5-[3-[(6-pyridin-2-yl-3-pyridinyl)methylamino]propyl]pyridin-2-amine?
5-[3-[(6-pyridin-2-yl-3-pyridinyl)methylamino]propyl]pyridin-2-amine has a molecular weight of 319.41 g/mol, XLogP of 2.84, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-[(6-pyridin-2-yl-3-pyridinyl)methylamino]propyl]pyridin-2-amine is sourced from PubChem (CID 146148338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).