6-methyl-2-N,2-N-dipropyl-4-N-(2,4,6-trimethylphenyl)-1,3,5-triazine-2,4-diamine

C19H29N5 — CID 10616216

IUPAC6-methyl-2-N,2-N-dipropyl-4-N-(2,4,6-trimethylphenyl)-1,3,5-triazine-2,4-diamine
SMILESCCCN(CCC)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1
InChIInChI=1S/C19H29N5/c1-7-9-24(10-8-2)19-21-16(6)20-18(23-19)22-17-14(4)11-13(3)12-15(17)5/h11-12H,7-10H2,1-6H3,(H,20,21,22,23)
InChIKeyNNXKPIFUBGDIBN-UHFFFAOYSA-N
MW327.48 g/mol
LogP4.48
Rot. Bonds7

About 6-methyl-2-N,2-N-dipropyl-4-N-(2,4,6-trimethylphenyl)-1,3,5-triazine-2,4-diamine

6-methyl-2-N,2-N-dipropyl-4-N-(2,4,6-trimethylphenyl)-1,3,5-triazine-2,4-diamine (PubChem CID 10616216) has the molecular formula C19H29N5 and a molecular weight of 327.48 g/mol. Its IUPAC name is 6-methyl-2-N,2-N-dipropyl-4-N-(2,4,6-trimethylphenyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-methyl-2-N,2-N-dipropyl-4-N-(2,4,6-trimethylphenyl)-1,3,5-triazine-2,4-diamine
PubChem CID10616216
Molecular FormulaC19H29N5
Molecular Weight327.48 g/mol
Exact Mass327.24
IUPAC Name6-methyl-2-N,2-N-dipropyl-4-N-(2,4,6-trimethylphenyl)-1,3,5-triazine-2,4-diamine
SMILESCCCN(CCC)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1
InChIInChI=1S/C19H29N5/c1-7-9-24(10-8-2)19-21-16(6)20-18(23-19)22-17-14(4)11-13(3)12-15(17)5/h11-12H,7-10H2,1-6H3,(H,20,21,22,23)
InChIKeyNNXKPIFUBGDIBN-UHFFFAOYSA-N
XLogP4.48
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.48
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-N,2-N-dipropyl-4-N-(2,4,6-trimethylphenyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-methyl-2-N,2-N-dipropyl-4-N-(2,4,6-trimethylphenyl)-1,3,5-triazine-2,4-diamine (CID 10616216) is 6-methyl-2-N,2-N-dipropyl-4-N-(2,4,6-trimethylphenyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-methyl-2-N,2-N-dipropyl-4-N-(2,4,6-trimethylphenyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-methyl-2-N,2-N-dipropyl-4-N-(2,4,6-trimethylphenyl)-1,3,5-triazine-2,4-diamine is CCCN(CCC)c1nc(C)nc(Nc2c(C)cc(C)cc2C)n1.
What is the InChIKey of 6-methyl-2-N,2-N-dipropyl-4-N-(2,4,6-trimethylphenyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is NNXKPIFUBGDIBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N5/c1-7-9-24(10-8-2)19-21-16(6)20-18(23-19)22-17-14(4)11-13(3)12-15(17)5/h11-12H,7-10H2,1-6H3,(H,20,21,22,23).
What are the key properties of 6-methyl-2-N,2-N-dipropyl-4-N-(2,4,6-trimethylphenyl)-1,3,5-triazine-2,4-diamine?
6-methyl-2-N,2-N-dipropyl-4-N-(2,4,6-trimethylphenyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 327.48 g/mol, XLogP of 4.48, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-N,2-N-dipropyl-4-N-(2,4,6-trimethylphenyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 10616216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).