N'-phenyl-N'-(6-phenyl-2-pyridinyl)-N-(pyridin-2-ylmethyl)methanediamine

C24H22N4 — CID 153419219

IUPACN'-phenyl-N'-(6-phenyl-2-pyridinyl)-N-(pyridin-2-ylmethyl)methanediamine
SMILESc1ccc(-c2cccc(N(CNCc3ccccn3)c3ccccc3)n2)cc1
InChIInChI=1S/C24H22N4/c1-3-10-20(11-4-1)23-15-9-16-24(27-23)28(22-13-5-2-6-14-22)19-25-18-21-12-7-8-17-26-21/h1-17,25H,18-19H2
InChIKeyXTDXCOIJZSXXJQ-UHFFFAOYSA-N
MW366.47 g/mol
LogP5.03
Rot. Bonds7

About N'-phenyl-N'-(6-phenyl-2-pyridinyl)-N-(pyridin-2-ylmethyl)methanediamine

N'-phenyl-N'-(6-phenyl-2-pyridinyl)-N-(pyridin-2-ylmethyl)methanediamine (PubChem CID 153419219) has the molecular formula C24H22N4 and a molecular weight of 366.47 g/mol. Its IUPAC name is N'-phenyl-N'-(6-phenyl-2-pyridinyl)-N-(pyridin-2-ylmethyl)methanediamine.

Molecular Properties

Compound NameN'-phenyl-N'-(6-phenyl-2-pyridinyl)-N-(pyridin-2-ylmethyl)methanediamine
PubChem CID153419219
Molecular FormulaC24H22N4
Molecular Weight366.47 g/mol
Exact Mass366.18
IUPAC NameN'-phenyl-N'-(6-phenyl-2-pyridinyl)-N-(pyridin-2-ylmethyl)methanediamine
SMILESc1ccc(-c2cccc(N(CNCc3ccccn3)c3ccccc3)n2)cc1
InChIInChI=1S/C24H22N4/c1-3-10-20(11-4-1)23-15-9-16-24(27-23)28(22-13-5-2-6-14-22)19-25-18-21-12-7-8-17-26-21/h1-17,25H,18-19H2
InChIKeyXTDXCOIJZSXXJQ-UHFFFAOYSA-N
XLogP5.03
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.47
LogP ≤ 55.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

N'-(6-phenoxy-2-pyridinyl)-N'-phenyl-N-(pyridin-2-ylmethyl)methanediamine
CID 153419194
1-(6-phenyl-2-pyridinyl)-N-[(6-phenyl-2-pyridinyl)methyl]-N-(pyridin-2-ylmethyl)methanamine
CID 57459973
N-(pyridin-2-ylmethyl)-1-[6-[(pyridin-2-ylmethylamino)methyl]-2-pyridinyl]methanamine
CID 564837
N,N-diphenyl-6-[3-(N-pyridin-2-ylanilino)phenyl]pyridin-2-amine
CID 23135801
zinc;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;dihydrochloride
CID 73345757
4-(4-phenylphenyl)-N-(pyridin-2-ylmethyl)aniline
CID 101246794
N'-(pyridin-2-ylmethyl)-N-[2-(pyridin-2-ylmethylamino)ethyl]ethane-1,2-diamine
CID 12029921
N-phenyl-N-(pyridin-2-ylmethyl)pyrimidin-2-amine
CID 141149663
N-[(6-methyl-2-pyridinyl)methyl]-1-pyridin-2-ylmethanamine
CID 15900109
2,6-diphenyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 59340687
N,N-diphenyl-3,5-bis[(pyridin-2-ylmethylamino)methyl]-1,2,4-triazol-4-amine
CID 102435269
2-phenyl-6-pyridin-2-ylpyridine;platinum(2+)
CID 161405876

Frequently Asked Questions

What is the IUPAC name of N'-phenyl-N'-(6-phenyl-2-pyridinyl)-N-(pyridin-2-ylmethyl)methanediamine?
The IUPAC name of N'-phenyl-N'-(6-phenyl-2-pyridinyl)-N-(pyridin-2-ylmethyl)methanediamine (CID 153419219) is N'-phenyl-N'-(6-phenyl-2-pyridinyl)-N-(pyridin-2-ylmethyl)methanediamine.
What is the SMILES notation for N'-phenyl-N'-(6-phenyl-2-pyridinyl)-N-(pyridin-2-ylmethyl)methanediamine?
The canonical SMILES for N'-phenyl-N'-(6-phenyl-2-pyridinyl)-N-(pyridin-2-ylmethyl)methanediamine is c1ccc(-c2cccc(N(CNCc3ccccn3)c3ccccc3)n2)cc1.
What is the InChIKey of N'-phenyl-N'-(6-phenyl-2-pyridinyl)-N-(pyridin-2-ylmethyl)methanediamine?
The InChIKey is XTDXCOIJZSXXJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N4/c1-3-10-20(11-4-1)23-15-9-16-24(27-23)28(22-13-5-2-6-14-22)19-25-18-21-12-7-8-17-26-21/h1-17,25H,18-19H2.
What are the key properties of N'-phenyl-N'-(6-phenyl-2-pyridinyl)-N-(pyridin-2-ylmethyl)methanediamine?
N'-phenyl-N'-(6-phenyl-2-pyridinyl)-N-(pyridin-2-ylmethyl)methanediamine has a molecular weight of 366.47 g/mol, XLogP of 5.03, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-phenyl-N'-(6-phenyl-2-pyridinyl)-N-(pyridin-2-ylmethyl)methanediamine is sourced from PubChem (CID 153419219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).