2-N-benzyl-4-N-(2,4-dimethylphenyl)-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine

C20H23N5 — CID 10664382

IUPAC2-N-benzyl-4-N-(2,4-dimethylphenyl)-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine
SMILESCc1ccc(Nc2nc(C)nc(N(C)Cc3ccccc3)n2)c(C)c1
InChIInChI=1S/C20H23N5/c1-14-10-11-18(15(2)12-14)23-19-21-16(3)22-20(24-19)25(4)13-17-8-6-5-7-9-17/h5-12H,13H2,1-4H3,(H,21,22,23,24)
InChIKeyYVAJVEWLCZMPLT-UHFFFAOYSA-N
MW333.44 g/mol
LogP4.18
Rot. Bonds5

About 2-N-benzyl-4-N-(2,4-dimethylphenyl)-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine

2-N-benzyl-4-N-(2,4-dimethylphenyl)-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine (PubChem CID 10664382) has the molecular formula C20H23N5 and a molecular weight of 333.44 g/mol. Its IUPAC name is 2-N-benzyl-4-N-(2,4-dimethylphenyl)-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-benzyl-4-N-(2,4-dimethylphenyl)-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine
PubChem CID10664382
Molecular FormulaC20H23N5
Molecular Weight333.44 g/mol
Exact Mass333.20
IUPAC Name2-N-benzyl-4-N-(2,4-dimethylphenyl)-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine
SMILESCc1ccc(Nc2nc(C)nc(N(C)Cc3ccccc3)n2)c(C)c1
InChIInChI=1S/C20H23N5/c1-14-10-11-18(15(2)12-14)23-19-21-16(3)22-20(24-19)25(4)13-17-8-6-5-7-9-17/h5-12H,13H2,1-4H3,(H,21,22,23,24)
InChIKeyYVAJVEWLCZMPLT-UHFFFAOYSA-N
XLogP4.18
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.44
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-N-benzyl-4-N-(2,4-dimethylphenyl)-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine with MolForge

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Related Compounds

2-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-N-(2,4-dimethylphenyl)-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine
CID 10501566
2-N,2-N-dibutyl-4-N-(2,4-dimethylphenyl)-6-methyl-1,3,5-triazine-2,4-diamine
CID 10617227
1-benzyl-2-(2,4-dimethylphenyl)-1-methylhydrazine
CID 57180134
2-N-(2,4-dimethylphenyl)-6-methyl-4-N-[2-(methylperoxymethyl)phenyl]-1,3,5-triazine-2,4-diamine
CID 88885125
2-[benzyl(methyl)amino]-N-(2,4-dimethylphenyl)pyrimidine-5-carboxamide
CID 109256795
N-benzyl-N,4,6-trimethylpyrimidin-2-amine
CID 734467
2-N-(cyclopropylmethyl)-4-N-(2,4-dimethylphenyl)-6-methyl-2-N-propyl-1,3,5-triazine-2,4-diamine
CID 10616065
5-N-benzyl-3-N-(4-chloro-2-methylphenyl)-5-N-methyl-1,2,4-triazine-3,5-diamine
CID 112949296
2-N-benzyl-6-hydrazinyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
CID 80917534
1-benzyl-3-(2,4-dimethylphenyl)-1-methylurea
CID 108988864
2-[(4-anilino-6-methyl-1,3,5-triazin-2-yl)-methylamino]ethanol
CID 67518527
5-N-benzyl-3-N-(2,4-dimethylphenyl)-1,2,4-triazine-3,5-diamine
CID 112947589

Frequently Asked Questions

What is the IUPAC name of 2-N-benzyl-4-N-(2,4-dimethylphenyl)-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-benzyl-4-N-(2,4-dimethylphenyl)-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine (CID 10664382) is 2-N-benzyl-4-N-(2,4-dimethylphenyl)-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-benzyl-4-N-(2,4-dimethylphenyl)-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-benzyl-4-N-(2,4-dimethylphenyl)-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine is Cc1ccc(Nc2nc(C)nc(N(C)Cc3ccccc3)n2)c(C)c1.
What is the InChIKey of 2-N-benzyl-4-N-(2,4-dimethylphenyl)-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine?
The InChIKey is YVAJVEWLCZMPLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5/c1-14-10-11-18(15(2)12-14)23-19-21-16(3)22-20(24-19)25(4)13-17-8-6-5-7-9-17/h5-12H,13H2,1-4H3,(H,21,22,23,24).
What are the key properties of 2-N-benzyl-4-N-(2,4-dimethylphenyl)-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine?
2-N-benzyl-4-N-(2,4-dimethylphenyl)-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine has a molecular weight of 333.44 g/mol, XLogP of 4.18, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-benzyl-4-N-(2,4-dimethylphenyl)-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 10664382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).