2-N,2-N,4-N,4-N,6-N,6-N-hexapropyl-1,3,5-triazine-2,4,6-triamine

C21H42N6 — CID 3600719

IUPAC2-N,2-N,4-N,4-N,6-N,6-N-hexapropyl-1,3,5-triazine-2,4,6-triamine
SMILESCCCN(CCC)c1nc(N(CCC)CCC)nc(N(CCC)CCC)n1
InChIInChI=1S/C21H42N6/c1-7-13-25(14-8-2)19-22-20(26(15-9-3)16-10-4)24-21(23-19)27(17-11-5)18-12-6/h7-18H2,1-6H3
InChIKeyBPWJOJGMQGGGGD-UHFFFAOYSA-N
MW378.61 g/mol
LogP4.75
Rot. Bonds15

About 2-N,2-N,4-N,4-N,6-N,6-N-hexapropyl-1,3,5-triazine-2,4,6-triamine

2-N,2-N,4-N,4-N,6-N,6-N-hexapropyl-1,3,5-triazine-2,4,6-triamine (PubChem CID 3600719) has the molecular formula C21H42N6 and a molecular weight of 378.61 g/mol. Its IUPAC name is 2-N,2-N,4-N,4-N,6-N,6-N-hexapropyl-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,2-N,4-N,4-N,6-N,6-N-hexapropyl-1,3,5-triazine-2,4,6-triamine
PubChem CID3600719
Molecular FormulaC21H42N6
Molecular Weight378.61 g/mol
Exact Mass378.35
IUPAC Name2-N,2-N,4-N,4-N,6-N,6-N-hexapropyl-1,3,5-triazine-2,4,6-triamine
SMILESCCCN(CCC)c1nc(N(CCC)CCC)nc(N(CCC)CCC)n1
InChIInChI=1S/C21H42N6/c1-7-13-25(14-8-2)19-22-20(26(15-9-3)16-10-4)24-21(23-19)27(17-11-5)18-12-6/h7-18H2,1-6H3
InChIKeyBPWJOJGMQGGGGD-UHFFFAOYSA-N
XLogP4.75
TPSA48.39 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds15
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.61
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-N,2-N,4-N,4-N,6-N,6-N-hexapropyl-1,3,5-triazine-2,4,6-triamine with MolForge

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Related Compounds

Chlorazine
CID 11380
2,4,6-Tris(diethylamino)-1,3,5-triazine
CID 17806
2-N,2-N-Diethyl-4-N,4-N,6-N,6-N-tetramethyl-1,3,5-triazine-2,4,6-triamine
CID 27777
s-Triazine, 2,4-bis(dimethylamino)-6-(1-pyrrolidinyl)-
CID 202886
s-Triazine, 2,6-diamino-4-dipropylamino-
CID 121256
[4,6-Bis(dimethylamino)-1,3,5-triazin-2-yl]ethylcyanamide
CID 773462
AG-F-96600
CID 21818
s-Triazine, 2,4-bis(diethylamino)-6-fluoro-
CID 15334
N,N-dibutyl-4,6-dichloro-1,3,5-triazin-2-amine
CID 15355831
Dibutylmelamine
CID 11310965
6-chloro-2-N,4-N-bis[3-(diethylamino)propyl]-1,3,5-triazine-2,4-diamine
CID 115995
1,3,5-Triazine-2,4-diamine, N2,N2,N4,N4-tetrabutyl-6-chloro-
CID 3750346

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,4-N,4-N,6-N,6-N-hexapropyl-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,2-N,4-N,4-N,6-N,6-N-hexapropyl-1,3,5-triazine-2,4,6-triamine (CID 3600719) is 2-N,2-N,4-N,4-N,6-N,6-N-hexapropyl-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,2-N,4-N,4-N,6-N,6-N-hexapropyl-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,2-N,4-N,4-N,6-N,6-N-hexapropyl-1,3,5-triazine-2,4,6-triamine is CCCN(CCC)c1nc(N(CCC)CCC)nc(N(CCC)CCC)n1.
What is the InChIKey of 2-N,2-N,4-N,4-N,6-N,6-N-hexapropyl-1,3,5-triazine-2,4,6-triamine?
The InChIKey is BPWJOJGMQGGGGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H42N6/c1-7-13-25(14-8-2)19-22-20(26(15-9-3)16-10-4)24-21(23-19)27(17-11-5)18-12-6/h7-18H2,1-6H3.
What are the key properties of 2-N,2-N,4-N,4-N,6-N,6-N-hexapropyl-1,3,5-triazine-2,4,6-triamine?
2-N,2-N,4-N,4-N,6-N,6-N-hexapropyl-1,3,5-triazine-2,4,6-triamine has a molecular weight of 378.61 g/mol, XLogP of 4.75, 15 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,4-N,4-N,6-N,6-N-hexapropyl-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 3600719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).