6-ethyl-2-N,4-N-dihexyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine

C19H37N5 — CID 159008981

IUPAC6-ethyl-2-N,4-N-dihexyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
SMILESCCCCCCN(C)c1nc(CC)nc(N(C)CCCCCC)n1
InChIInChI=1S/C19H37N5/c1-6-9-11-13-15-23(4)18-20-17(8-3)21-19(22-18)24(5)16-14-12-10-7-2/h6-16H2,1-5H3
InChIKeyGJIZTIIQNUBMHT-UHFFFAOYSA-N
MW335.54 g/mol
LogP4.47
Rot. Bonds13

About 6-ethyl-2-N,4-N-dihexyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine

6-ethyl-2-N,4-N-dihexyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine (PubChem CID 159008981) has the molecular formula C19H37N5 and a molecular weight of 335.54 g/mol. Its IUPAC name is 6-ethyl-2-N,4-N-dihexyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-ethyl-2-N,4-N-dihexyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
PubChem CID159008981
Molecular FormulaC19H37N5
Molecular Weight335.54 g/mol
Exact Mass335.30
IUPAC Name6-ethyl-2-N,4-N-dihexyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
SMILESCCCCCCN(C)c1nc(CC)nc(N(C)CCCCCC)n1
InChIInChI=1S/C19H37N5/c1-6-9-11-13-15-23(4)18-20-17(8-3)21-19(22-18)24(5)16-14-12-10-7-2/h6-16H2,1-5H3
InChIKeyGJIZTIIQNUBMHT-UHFFFAOYSA-N
XLogP4.47
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds13
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.54
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 6-ethyl-2-N,4-N-dihexyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine with MolForge

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Related Compounds

6-chloro-2-N,4-N-dimethyl-2-N,4-N-dioctadecyl-1,3,5-triazine-2,4-diamine
CID 3681496
4,6-dichloro-N-methyl-N-octadecyl-1,3,5-triazin-2-amine
CID 3103368
4-N-butyl-6-chloro-2-N,2-N-diethyl-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 62870530
6-N-methyl-6-N-(methylaminomethyl)-2-N,2-N,4-N,4-N-tetraoctyl-1,3,5-triazine-2,4,6-triamine
CID 59356287
2-ethyl-4-N,6-N-dimethyl-4-N-pentylpyrimidine-4,6-diamine
CID 80933276
2,4-didecyl-6-ethyl-1,3,5-triazine
CID 123764095
2-N-[6-(dimethylamino)hexyl]-4-N-hexyl-2-N,6-dimethyl-1,3,5-triazine-2,4-diamine
CID 59132939
2-[hexyl(methyl)amino]-4-methylpyrimidine-5-carboxylic acid
CID 91210438
4-N-butyl-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80916617
N-methyl-N-pentacosylpentacosan-1-amine
CID 118952569
N,N-dimethyloctan-1-amine
CID 161279104
N,N'-dimethyl-N,N'-dioctyldecane-1,10-diamine
CID 19772875

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-N,4-N-dihexyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-ethyl-2-N,4-N-dihexyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine (CID 159008981) is 6-ethyl-2-N,4-N-dihexyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-ethyl-2-N,4-N-dihexyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-ethyl-2-N,4-N-dihexyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine is CCCCCCN(C)c1nc(CC)nc(N(C)CCCCCC)n1.
What is the InChIKey of 6-ethyl-2-N,4-N-dihexyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine?
The InChIKey is GJIZTIIQNUBMHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H37N5/c1-6-9-11-13-15-23(4)18-20-17(8-3)21-19(22-18)24(5)16-14-12-10-7-2/h6-16H2,1-5H3.
What are the key properties of 6-ethyl-2-N,4-N-dihexyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine?
6-ethyl-2-N,4-N-dihexyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine has a molecular weight of 335.54 g/mol, XLogP of 4.47, 13 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-N,4-N-dihexyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 159008981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).