2-N,2-N,6-N,6-N-tetrakis(2-methylphenyl)pyridine-2,6-diamine

C33H31N3 — CID 59372096

IUPAC2-N,2-N,6-N,6-N-tetrakis(2-methylphenyl)pyridine-2,6-diamine
SMILESCc1ccccc1N(c1cccc(N(c2ccccc2C)c2ccccc2C)n1)c1ccccc1C
InChIInChI=1S/C33H31N3/c1-24-14-5-9-18-28(24)35(29-19-10-6-15-25(29)2)32-22-13-23-33(34-32)36(30-20-11-7-16-26(30)3)31-21-12-8-17-27(31)4/h5-23H,1-4H3
InChIKeyQJQBKBMLLZLATJ-UHFFFAOYSA-N
MW469.63 g/mol
LogP9.25
Rot. Bonds6

About 2-N,2-N,6-N,6-N-tetrakis(2-methylphenyl)pyridine-2,6-diamine

2-N,2-N,6-N,6-N-tetrakis(2-methylphenyl)pyridine-2,6-diamine (PubChem CID 59372096) has the molecular formula C33H31N3 and a molecular weight of 469.63 g/mol. Its IUPAC name is 2-N,2-N,6-N,6-N-tetrakis(2-methylphenyl)pyridine-2,6-diamine.

Molecular Properties

Compound Name2-N,2-N,6-N,6-N-tetrakis(2-methylphenyl)pyridine-2,6-diamine
PubChem CID59372096
Molecular FormulaC33H31N3
Molecular Weight469.63 g/mol
Exact Mass469.25
IUPAC Name2-N,2-N,6-N,6-N-tetrakis(2-methylphenyl)pyridine-2,6-diamine
SMILESCc1ccccc1N(c1cccc(N(c2ccccc2C)c2ccccc2C)n1)c1ccccc1C
InChIInChI=1S/C33H31N3/c1-24-14-5-9-18-28(24)35(29-19-10-6-15-25(29)2)32-22-13-23-33(34-32)36(30-20-11-7-16-26(30)3)31-21-12-8-17-27(31)4/h5-23H,1-4H3
InChIKeyQJQBKBMLLZLATJ-UHFFFAOYSA-N
XLogP9.25
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500469.63
LogP ≤ 59.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-N,3-N,6-N,8-N-tetrakis(2-methylphenyl)-1-N,3-N,6-N,8-N-tetra(pyrazin-2-yl)pyrene-1,3,6,8-tetramine
CID 176881252
6-[1-[4,6-bis(2-methyl-N-(2-methylphenyl)anilino)-1,3,5-triazin-2-yl]ethenyl]-2-N,2-N,4-N,4-N-tetrakis(2-methylphenyl)-1,3,5-triazine-2,4-diamine
CID 89110234
2-methyl-N,N-bis(trimethylsilyl)aniline
CID 22924503
2-methyl-N-(2-methylphenyl)-N-phosphanylaniline
CID 158300974
6-methyl-N,N-diphenylpyridin-2-amine
CID 101223687
6-(N-ethyl-2-methylanilino)pyridine-2-carbonitrile
CID 64587866
N,N-bis(2-methylphenyl)-1-naphthalen-1-ylnaphthalen-2-amine
CID 164774492
N-(2-methylphenyl)-N-phenanthren-4-ylphenanthren-1-amine
CID 140898010
2-N,3-N,4-N-tris(2-methylphenyl)-1-N,1-N,2-N,3-N,4-N-pentakis-phenylbenzene-1,2,3,4-tetramine
CID 69050247
N-(4-bromophenyl)-N-(2-methylphenyl)pyridin-4-amine
CID 67286698
1-N,3-N-bis(2-methylphenyl)-1-N,3-N-di(pyren-1-yl)benzene-1,3-diamine
CID 15220908
6-[bis[6-(N-(2-methoxyphenyl)anilino)-2-pyridinyl]phosphoryl]-N-(2-methylphenyl)-N-phenylpyridin-2-amine;6-[bis[6-(N-(2-methylphenyl)anilino)-2-pyridinyl]phosphoryl]-N-(2-methylphenyl)-N-phenylpyridin-2-amine;6-[bis[6-(N-(3-phenoxyphenyl)anilino)-2-pyridinyl]phosphoryl]-N-(3-phenoxyphenyl)-N-phenylpyridin-2-amine;6-[bis[6-(N-phenylanilino)-2-pyridinyl]phosphoryl]-N,N-diphenylpyridin-2-amine
CID 158143943

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,6-N,6-N-tetrakis(2-methylphenyl)pyridine-2,6-diamine?
The IUPAC name of 2-N,2-N,6-N,6-N-tetrakis(2-methylphenyl)pyridine-2,6-diamine (CID 59372096) is 2-N,2-N,6-N,6-N-tetrakis(2-methylphenyl)pyridine-2,6-diamine.
What is the SMILES notation for 2-N,2-N,6-N,6-N-tetrakis(2-methylphenyl)pyridine-2,6-diamine?
The canonical SMILES for 2-N,2-N,6-N,6-N-tetrakis(2-methylphenyl)pyridine-2,6-diamine is Cc1ccccc1N(c1cccc(N(c2ccccc2C)c2ccccc2C)n1)c1ccccc1C.
What is the InChIKey of 2-N,2-N,6-N,6-N-tetrakis(2-methylphenyl)pyridine-2,6-diamine?
The InChIKey is QJQBKBMLLZLATJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H31N3/c1-24-14-5-9-18-28(24)35(29-19-10-6-15-25(29)2)32-22-13-23-33(34-32)36(30-20-11-7-16-26(30)3)31-21-12-8-17-27(31)4/h5-23H,1-4H3.
What are the key properties of 2-N,2-N,6-N,6-N-tetrakis(2-methylphenyl)pyridine-2,6-diamine?
2-N,2-N,6-N,6-N-tetrakis(2-methylphenyl)pyridine-2,6-diamine has a molecular weight of 469.63 g/mol, XLogP of 9.25, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,6-N,6-N-tetrakis(2-methylphenyl)pyridine-2,6-diamine is sourced from PubChem (CID 59372096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).