4-N,6-N-ditert-butyl-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine

C15H30N6 — CID 678233

IUPAC4-N,6-N-ditert-butyl-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine
SMILESCCN(CC)c1nc(NC(C)(C)C)nc(NC(C)(C)C)n1
InChIInChI=1S/C15H30N6/c1-9-21(10-2)13-17-11(19-14(3,4)5)16-12(18-13)20-15(6,7)8/h9-10H2,1-8H3,(H2,16,17,18,19,20)
InChIKeyNTZBADKSITUIKF-UHFFFAOYSA-N
MW294.45 g/mol
LogP3.14
Rot. Bonds5

About 4-N,6-N-ditert-butyl-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine

4-N,6-N-ditert-butyl-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine (PubChem CID 678233) has the molecular formula C15H30N6 and a molecular weight of 294.45 g/mol. Its IUPAC name is 4-N,6-N-ditert-butyl-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name4-N,6-N-ditert-butyl-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine
PubChem CID678233
Molecular FormulaC15H30N6
Molecular Weight294.45 g/mol
Exact Mass294.25
IUPAC Name4-N,6-N-ditert-butyl-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine
SMILESCCN(CC)c1nc(NC(C)(C)C)nc(NC(C)(C)C)n1
InChIInChI=1S/C15H30N6/c1-9-21(10-2)13-17-11(19-14(3,4)5)16-12(18-13)20-15(6,7)8/h9-10H2,1-8H3,(H2,16,17,18,19,20)
InChIKeyNTZBADKSITUIKF-UHFFFAOYSA-N
XLogP3.14
TPSA65.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.45
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-N,6-N-ditert-butyl-2-N,2-N-diethyl-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

Terbuthylazine
CID 22206
Propazine
CID 4937
Terbumeton
CID 36584
Trietazine
CID 15951
N-(4,6-Bis((1-methylethyl)amino)-1,3,5-triazin-2-yl)-N-methylcyanamide
CID 49968
1,3,5-Triazine-2,4-diamine, 6-chloro-N,N'-bis(1,1-dimethylethyl)-
CID 604080
Heptazine
CID 15950
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
Amino[4,6-bis(ethylamino)(1,3,5-triazin-2-yl)](methylethyl)carbonitrile
CID 826227
(4-Ethylamino-6-isopropylamino-[1,3,5]triazin-2-yl)-methyl-cyanamide
CID 910908
4-(Tert-butylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl(ethyl)cyanamide
CID 3128115

Frequently Asked Questions

What is the IUPAC name of 4-N,6-N-ditert-butyl-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 4-N,6-N-ditert-butyl-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine (CID 678233) is 4-N,6-N-ditert-butyl-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 4-N,6-N-ditert-butyl-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 4-N,6-N-ditert-butyl-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine is CCN(CC)c1nc(NC(C)(C)C)nc(NC(C)(C)C)n1.
What is the InChIKey of 4-N,6-N-ditert-butyl-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine?
The InChIKey is NTZBADKSITUIKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N6/c1-9-21(10-2)13-17-11(19-14(3,4)5)16-12(18-13)20-15(6,7)8/h9-10H2,1-8H3,(H2,16,17,18,19,20).
What are the key properties of 4-N,6-N-ditert-butyl-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine?
4-N,6-N-ditert-butyl-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine has a molecular weight of 294.45 g/mol, XLogP of 3.14, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,6-N-ditert-butyl-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 678233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).