2-N,2-N,4-N,4-N-tetrakis[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine

C34H68N6O12 — CID 58868228

IUPAC2-N,2-N,4-N,4-N-tetrakis[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine
SMILESCCCNc1nc(N(CCOCCOCCOC)CCOCCOCCOC)nc(N(CCOCCOCCOC)CCOCCOCCOC)n1
InChIInChI=1S/C34H68N6O12/c1-6-7-35-32-36-33(39(8-12-45-24-28-49-20-16-41-2)9-13-46-25-29-50-21-17-42-3)38-34(37-32)40(10-14-47-26-30-51-22-18-43-4)11-15-48-27-31-52-23-19-44-5/h6-31H2,1-5H3,(H,35,36,37,38)
InChIKeyZAAIDDVOMZFKML-UHFFFAOYSA-N
MW752.95 g/mol
LogP1.02
Rot. Bonds41

About 2-N,2-N,4-N,4-N-tetrakis[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine

2-N,2-N,4-N,4-N-tetrakis[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine (PubChem CID 58868228) has the molecular formula C34H68N6O12 and a molecular weight of 752.95 g/mol. Its IUPAC name is 2-N,2-N,4-N,4-N-tetrakis[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,2-N,4-N,4-N-tetrakis[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine
PubChem CID58868228
Molecular FormulaC34H68N6O12
Molecular Weight752.95 g/mol
Exact Mass752.49
IUPAC Name2-N,2-N,4-N,4-N-tetrakis[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine
SMILESCCCNc1nc(N(CCOCCOCCOC)CCOCCOCCOC)nc(N(CCOCCOCCOC)CCOCCOCCOC)n1
InChIInChI=1S/C34H68N6O12/c1-6-7-35-32-36-33(39(8-12-45-24-28-49-20-16-41-2)9-13-46-25-29-50-21-17-42-3)38-34(37-32)40(10-14-47-26-30-51-22-18-43-4)11-15-48-27-31-52-23-19-44-5/h6-31H2,1-5H3,(H,35,36,37,38)
InChIKeyZAAIDDVOMZFKML-UHFFFAOYSA-N
XLogP1.02
TPSA167.94 Ų
H-Bond Donors1
H-Bond Acceptors18
Rotatable Bonds41
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500752.95
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-N,2-N,4-N,4-N-tetrakis[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-N,4-N,6-N-tris[2-(2-methylpropoxy)ethyl]-1,3,5-triazine-2,4,6-triamine
CID 53772608
N-(5,8,11-Trioxa-2,14,16,18,19-pentaazabicyclo[13.3.1]nonadeca-1(18),15(19),16(17)-trien-17-yl)-N,O-dimethylhydroxylamine
CID 57378132
2-N,4-N,6-N-tris(2-propoxyethyl)-1,3,5-triazine-2,4,6-triamine
CID 58097420
6-chloro-4-N-methyl-2-N-[2-(2-propoxyethoxy)ethyl]-1,3,5-triazine-2,4-diamine
CID 58479544
2-N,4-N,6-N-tris[3-[2-[2-[2-(dibutylamino)ethoxy]ethoxy]ethoxy]propyl]-1,3,5-triazine-2,4,6-triamine
CID 58841537
2-[2-[2-[2-[2-[[4,6-Bis(4-aminobutylamino)-1,3,5-triazin-2-yl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 122674467
2-N,2-N,4-N,4-N-tetrakis[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethyl]-1,3,5-triazine-2,4,6-triamine
CID 131987347
6-N-(2-aminoethyl)-2-N,2-N,4-N,4-N-tetrakis[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethyl]-1,3,5-triazine-2,4,6-triamine
CID 138542429
(4,6-Dimethoxy-1,3,5-triazin-2-yl)-methyl-(2-propoxyethyl)azanium
CID 142357381
4-chloro-N-hexadecyl-6-(1,4,10-trioxa-7,13-diazacyclopentadec-7-yl)-1,3,5-triazin-2-amine
CID 144387717
6-N-(2-aminoethyl)-2-N,2-N,4-N,4-N-tetrakis[2-[2-(2-azidoethoxy)ethoxy]ethyl]-1,3,5-triazine-2,4,6-triamine
CID 163727578
4,6-bis[2-[2-(2-diethylphosphanylethoxy)ethoxy]ethoxy]-N-[2-[2-(2-diethylphosphanylethoxy)ethoxy]ethyl]-1,3,5-triazin-2-amine
CID 165377098

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,4-N,4-N-tetrakis[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,2-N,4-N,4-N-tetrakis[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine (CID 58868228) is 2-N,2-N,4-N,4-N-tetrakis[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,2-N,4-N,4-N-tetrakis[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,2-N,4-N,4-N-tetrakis[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine is CCCNc1nc(N(CCOCCOCCOC)CCOCCOCCOC)nc(N(CCOCCOCCOC)CCOCCOCCOC)n1.
What is the InChIKey of 2-N,2-N,4-N,4-N-tetrakis[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine?
The InChIKey is ZAAIDDVOMZFKML-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H68N6O12/c1-6-7-35-32-36-33(39(8-12-45-24-28-49-20-16-41-2)9-13-46-25-29-50-21-17-42-3)38-34(37-32)40(10-14-47-26-30-51-22-18-43-4)11-15-48-27-31-52-23-19-44-5/h6-31H2,1-5H3,(H,35,36,37,38).
What are the key properties of 2-N,2-N,4-N,4-N-tetrakis[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine?
2-N,2-N,4-N,4-N-tetrakis[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine has a molecular weight of 752.95 g/mol, XLogP of 1.02, 41 rotatable bonds, 1 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,4-N,4-N-tetrakis[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 58868228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).