(2R)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-2H-1,3,5-triazine-4,6-diamine

C17H19N5O — CID 732266

IUPAC(2R)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-2H-1,3,5-triazine-4,6-diamine
SMILESCOc1ccc([C@@H]2N=C(N)N=C(N)N2c2ccc(C)cc2)cc1
InChIInChI=1S/C17H19N5O/c1-11-3-7-13(8-4-11)22-15(20-16(18)21-17(22)19)12-5-9-14(23-2)10-6-12/h3-10,15H,1-2H3,(H4,18,19,20,21)/t15-/m1/s1
InChIKeyVZSYIRKPZUZAOC-OAHLLOKOSA-N
MW309.37 g/mol
LogP2.15
Rot. Bonds3

About (2R)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-2H-1,3,5-triazine-4,6-diamine

(2R)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-2H-1,3,5-triazine-4,6-diamine (PubChem CID 732266) has the molecular formula C17H19N5O and a molecular weight of 309.37 g/mol. Its IUPAC name is (2R)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-2H-1,3,5-triazine-4,6-diamine.

Molecular Properties

Compound Name(2R)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-2H-1,3,5-triazine-4,6-diamine
PubChem CID732266
Molecular FormulaC17H19N5O
Molecular Weight309.37 g/mol
Exact Mass309.16
IUPAC Name(2R)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-2H-1,3,5-triazine-4,6-diamine
SMILESCOc1ccc([C@@H]2N=C(N)N=C(N)N2c2ccc(C)cc2)cc1
InChIInChI=1S/C17H19N5O/c1-11-3-7-13(8-4-11)22-15(20-16(18)21-17(22)19)12-5-9-14(23-2)10-6-12/h3-10,15H,1-2H3,(H4,18,19,20,21)/t15-/m1/s1
InChIKeyVZSYIRKPZUZAOC-OAHLLOKOSA-N
XLogP2.15
TPSA89.23 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-(4-chlorophenyl)-2-(4-methoxyphenyl)-2H-1,3,5-triazine-4,6-diamine
CID 2852146
2,5-bis(4-methoxyphenyl)-4-methyl-3-[4-(4-methylphenyl)phenyl]-2,4-dihydroimidazole
CID 166797832
1-(4-methoxyphenyl)-3-methyl-4-(4-methylphenyl)azetidin-2-one
CID 75219177
1-[3-(4-methoxyphenoxy)propyl]-2-phenyl-2H-1,3,5-triazine-4,6-diamine;hydrochloride
CID 50939110
(3S,4R)-3-methoxy-1-(4-methoxyphenyl)-4-(4-methylphenyl)azetidin-2-one
CID 102052302
2,5-bis(4-methoxyphenyl)-1,3-bis(4-methylphenyl)-2,3-dihydropyrrole
CID 90120132
1-(113C)methoxy-4-methylbenzene
CID 166176950
3-acetyl-4-hydroxy-2-(4-methoxyphenyl)-1-(4-methylphenyl)-2H-pyrrol-5-one
CID 2868511
(3S,4S)-1,4-bis(4-methoxyphenyl)-3-(4-methylphenyl)sulfanylazetidin-2-one
CID 154585966
5-(4-methoxyphenyl)-3-methyl-4-(4-methylphenyl)-2,4-dihydropyrrolo[3,4-c]pyrazol-6-one
CID 73438724
(4R,5R)-1,3,4,5-tetrakis(4-methoxyphenyl)imidazolidin-2-one
CID 11124062
1,4-dimethoxybenzene;ethane;methane;1,4-xylene
CID 161140185

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-2H-1,3,5-triazine-4,6-diamine?
The IUPAC name of (2R)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-2H-1,3,5-triazine-4,6-diamine (CID 732266) is (2R)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-2H-1,3,5-triazine-4,6-diamine.
What is the SMILES notation for (2R)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-2H-1,3,5-triazine-4,6-diamine?
The canonical SMILES for (2R)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-2H-1,3,5-triazine-4,6-diamine is COc1ccc([C@@H]2N=C(N)N=C(N)N2c2ccc(C)cc2)cc1.
What is the InChIKey of (2R)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-2H-1,3,5-triazine-4,6-diamine?
The InChIKey is VZSYIRKPZUZAOC-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H19N5O/c1-11-3-7-13(8-4-11)22-15(20-16(18)21-17(22)19)12-5-9-14(23-2)10-6-12/h3-10,15H,1-2H3,(H4,18,19,20,21)/t15-/m1/s1.
What are the key properties of (2R)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-2H-1,3,5-triazine-4,6-diamine?
(2R)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-2H-1,3,5-triazine-4,6-diamine has a molecular weight of 309.37 g/mol, XLogP of 2.15, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-methoxyphenyl)-1-(4-methylphenyl)-2H-1,3,5-triazine-4,6-diamine is sourced from PubChem (CID 732266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).