2-N,4-N,6-N-tris(2-methylpropyl)-1,3,5-triazine-2,4,6-triamine

C15H30N6 — CID 11737971

IUPAC2-N,4-N,6-N-tris(2-methylpropyl)-1,3,5-triazine-2,4,6-triamine
SMILESCC(C)CNc1nc(NCC(C)C)nc(NCC(C)C)n1
InChIInChI=1S/C15H30N6/c1-10(2)7-16-13-19-14(17-8-11(3)4)21-15(20-13)18-9-12(5)6/h10-12H,7-9H2,1-6H3,(H3,16,17,18,19,20,21)
InChIKeyINPNTJXENMTKQG-UHFFFAOYSA-N
MW294.45 g/mol
LogP3.08
Rot. Bonds9

About 2-N,4-N,6-N-tris(2-methylpropyl)-1,3,5-triazine-2,4,6-triamine

2-N,4-N,6-N-tris(2-methylpropyl)-1,3,5-triazine-2,4,6-triamine (PubChem CID 11737971) has the molecular formula C15H30N6 and a molecular weight of 294.45 g/mol. Its IUPAC name is 2-N,4-N,6-N-tris(2-methylpropyl)-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,4-N,6-N-tris(2-methylpropyl)-1,3,5-triazine-2,4,6-triamine
PubChem CID11737971
Molecular FormulaC15H30N6
Molecular Weight294.45 g/mol
Exact Mass294.25
IUPAC Name2-N,4-N,6-N-tris(2-methylpropyl)-1,3,5-triazine-2,4,6-triamine
SMILESCC(C)CNc1nc(NCC(C)C)nc(NCC(C)C)n1
InChIInChI=1S/C15H30N6/c1-10(2)7-16-13-19-14(17-8-11(3)4)21-15(20-13)18-9-12(5)6/h10-12H,7-9H2,1-6H3,(H3,16,17,18,19,20,21)
InChIKeyINPNTJXENMTKQG-UHFFFAOYSA-N
XLogP3.08
TPSA74.76 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.45
LogP ≤ 53.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

Terbuthylazine
CID 22206
Atrazine
CID 2256
Propazine
CID 4937
Terbumeton
CID 36584
Secbumeton
CID 33443
Sebuthylazine
CID 23712
Trietazine
CID 15951
N-(4,6-Bis((1-methylethyl)amino)-1,3,5-triazin-2-yl)-N-methylcyanamide
CID 49968
4-N,6-N-ditert-butyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine
CID 744450
1,3,5-Triazine, 2-tert-butylamino-4-chloro-6-propylamino-
CID 615138
N-Butyl-1,3,5-triazine-2,4,6-triamine
CID 197831
Amino[4,6-bis(ethylamino)(1,3,5-triazin-2-yl)](methylethyl)carbonitrile
CID 826227

Frequently Asked Questions

What is the IUPAC name of 2-N,4-N,6-N-tris(2-methylpropyl)-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,4-N,6-N-tris(2-methylpropyl)-1,3,5-triazine-2,4,6-triamine (CID 11737971) is 2-N,4-N,6-N-tris(2-methylpropyl)-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,4-N,6-N-tris(2-methylpropyl)-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,4-N,6-N-tris(2-methylpropyl)-1,3,5-triazine-2,4,6-triamine is CC(C)CNc1nc(NCC(C)C)nc(NCC(C)C)n1.
What is the InChIKey of 2-N,4-N,6-N-tris(2-methylpropyl)-1,3,5-triazine-2,4,6-triamine?
The InChIKey is INPNTJXENMTKQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N6/c1-10(2)7-16-13-19-14(17-8-11(3)4)21-15(20-13)18-9-12(5)6/h10-12H,7-9H2,1-6H3,(H3,16,17,18,19,20,21).
What are the key properties of 2-N,4-N,6-N-tris(2-methylpropyl)-1,3,5-triazine-2,4,6-triamine?
2-N,4-N,6-N-tris(2-methylpropyl)-1,3,5-triazine-2,4,6-triamine has a molecular weight of 294.45 g/mol, XLogP of 3.08, 9 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N,6-N-tris(2-methylpropyl)-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 11737971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).