2-N-(2,4-dimethylphenyl)-4-N-(3-methoxyphenyl)-6-methyl-1,3,5-triazine-2,4-diamine

C19H21N5O — CID 10520798

IUPAC2-N-(2,4-dimethylphenyl)-4-N-(3-methoxyphenyl)-6-methyl-1,3,5-triazine-2,4-diamine
SMILESCOc1cccc(Nc2nc(C)nc(Nc3ccc(C)cc3C)n2)c1
InChIInChI=1S/C19H21N5O/c1-12-8-9-17(13(2)10-12)23-19-21-14(3)20-18(24-19)22-15-6-5-7-16(11-15)25-4/h5-11H,1-4H3,(H2,20,21,22,23,24)
InChIKeyLMEAYCNLKSPMEC-UHFFFAOYSA-N
MW335.41 g/mol
LogP4.29
Rot. Bonds5

About 2-N-(2,4-dimethylphenyl)-4-N-(3-methoxyphenyl)-6-methyl-1,3,5-triazine-2,4-diamine

2-N-(2,4-dimethylphenyl)-4-N-(3-methoxyphenyl)-6-methyl-1,3,5-triazine-2,4-diamine (PubChem CID 10520798) has the molecular formula C19H21N5O and a molecular weight of 335.41 g/mol. Its IUPAC name is 2-N-(2,4-dimethylphenyl)-4-N-(3-methoxyphenyl)-6-methyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-(2,4-dimethylphenyl)-4-N-(3-methoxyphenyl)-6-methyl-1,3,5-triazine-2,4-diamine
PubChem CID10520798
Molecular FormulaC19H21N5O
Molecular Weight335.41 g/mol
Exact Mass335.17
IUPAC Name2-N-(2,4-dimethylphenyl)-4-N-(3-methoxyphenyl)-6-methyl-1,3,5-triazine-2,4-diamine
SMILESCOc1cccc(Nc2nc(C)nc(Nc3ccc(C)cc3C)n2)c1
InChIInChI=1S/C19H21N5O/c1-12-8-9-17(13(2)10-12)23-19-21-14(3)20-18(24-19)22-15-6-5-7-16(11-15)25-4/h5-11H,1-4H3,(H2,20,21,22,23,24)
InChIKeyLMEAYCNLKSPMEC-UHFFFAOYSA-N
XLogP4.29
TPSA71.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 54.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2,4-dimethylphenyl)-6-(3-methoxyanilino)-2-methylpyrimidine-4-carboxamide
CID 112848883
4-N-(2,5-dimethylphenyl)-2-N-(3-methoxyphenyl)-6-methylpyrimidine-2,4-diamine
CID 112928074
2-N-(2,4-dimethylphenyl)-6-methyl-4-N-(4-methylsulfanylphenyl)-1,3,5-triazine-2,4-diamine
CID 10712923
N-(2,4-dimethylphenyl)-2-(3-methoxyanilino)pyrimidine-5-carboxamide
CID 109266400
2-N-(2,4-dimethylphenyl)-4-N-(4-methoxyphenyl)-6-methylpyrimidine-2,4-diamine
CID 112928025
N-[4-[(E)-2-(3-methoxyphenyl)ethenyl]phenyl]-2,4-dimethylaniline
CID 20813152
2-N-(2,4-dimethylphenyl)-6-methyl-4-N-[2-(methylperoxymethyl)phenyl]-1,3,5-triazine-2,4-diamine
CID 88885125
2-N,4-N-bis(3-chlorophenyl)-6-N-(4-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine;2-N,4-N-bis(3-chlorophenyl)-6-N-phenyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-bis(2-methylphenyl)-6-N-(3-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N,4-N-bis(2-methylphenyl)-6-N-(4-methylphenyl)-1,3,5-triazine-2,4,6-triamine;2-N,4-N-bis(2-methylphenyl)-6-N-phenyl-1,3,5-triazine-2,4,6-triamine
CID 162030855
3-N-(2,5-dimethylphenyl)-5-N-(3-methoxyphenyl)-1,2,4-triazine-3,5-diamine
CID 112963240
1-(2,4-dimethylphenyl)-3-(3-methoxyphenyl)urea
CID 6469067
4-N-(3-methoxyphenyl)-6-methyl-2-N-(3-methylphenyl)pyrimidine-2,4-diamine
CID 112927268
3,4-bis(3-methoxyanilino)cyclobut-3-ene-1,2-dione
CID 2824412

Frequently Asked Questions

What is the IUPAC name of 2-N-(2,4-dimethylphenyl)-4-N-(3-methoxyphenyl)-6-methyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-(2,4-dimethylphenyl)-4-N-(3-methoxyphenyl)-6-methyl-1,3,5-triazine-2,4-diamine (CID 10520798) is 2-N-(2,4-dimethylphenyl)-4-N-(3-methoxyphenyl)-6-methyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-(2,4-dimethylphenyl)-4-N-(3-methoxyphenyl)-6-methyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-(2,4-dimethylphenyl)-4-N-(3-methoxyphenyl)-6-methyl-1,3,5-triazine-2,4-diamine is COc1cccc(Nc2nc(C)nc(Nc3ccc(C)cc3C)n2)c1.
What is the InChIKey of 2-N-(2,4-dimethylphenyl)-4-N-(3-methoxyphenyl)-6-methyl-1,3,5-triazine-2,4-diamine?
The InChIKey is LMEAYCNLKSPMEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O/c1-12-8-9-17(13(2)10-12)23-19-21-14(3)20-18(24-19)22-15-6-5-7-16(11-15)25-4/h5-11H,1-4H3,(H2,20,21,22,23,24).
What are the key properties of 2-N-(2,4-dimethylphenyl)-4-N-(3-methoxyphenyl)-6-methyl-1,3,5-triazine-2,4-diamine?
2-N-(2,4-dimethylphenyl)-4-N-(3-methoxyphenyl)-6-methyl-1,3,5-triazine-2,4-diamine has a molecular weight of 335.41 g/mol, XLogP of 4.29, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2,4-dimethylphenyl)-4-N-(3-methoxyphenyl)-6-methyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 10520798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).