2-N-butan-2-yl-2-N,4-N,4-N-triethyl-6-N-methyl-1,3,5-triazine-2,4,6-triamine

C14H28N6 — CID 80783122

IUPAC2-N-butan-2-yl-2-N,4-N,4-N-triethyl-6-N-methyl-1,3,5-triazine-2,4,6-triamine
SMILESCCC(C)N(CC)c1nc(NC)nc(N(CC)CC)n1
InChIInChI=1S/C14H28N6/c1-7-11(5)20(10-4)14-17-12(15-6)16-13(18-14)19(8-2)9-3/h11H,7-10H2,1-6H3,(H,15,16,17,18)
InChIKeyZQYNQVKDTJFYTO-UHFFFAOYSA-N
MW280.42 g/mol
LogP2.38
Rot. Bonds8

About 2-N-butan-2-yl-2-N,4-N,4-N-triethyl-6-N-methyl-1,3,5-triazine-2,4,6-triamine

2-N-butan-2-yl-2-N,4-N,4-N-triethyl-6-N-methyl-1,3,5-triazine-2,4,6-triamine (PubChem CID 80783122) has the molecular formula C14H28N6 and a molecular weight of 280.42 g/mol. Its IUPAC name is 2-N-butan-2-yl-2-N,4-N,4-N-triethyl-6-N-methyl-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N-butan-2-yl-2-N,4-N,4-N-triethyl-6-N-methyl-1,3,5-triazine-2,4,6-triamine
PubChem CID80783122
Molecular FormulaC14H28N6
Molecular Weight280.42 g/mol
Exact Mass280.24
IUPAC Name2-N-butan-2-yl-2-N,4-N,4-N-triethyl-6-N-methyl-1,3,5-triazine-2,4,6-triamine
SMILESCCC(C)N(CC)c1nc(NC)nc(N(CC)CC)n1
InChIInChI=1S/C14H28N6/c1-7-11(5)20(10-4)14-17-12(15-6)16-13(18-14)19(8-2)9-3/h11H,7-10H2,1-6H3,(H,15,16,17,18)
InChIKeyZQYNQVKDTJFYTO-UHFFFAOYSA-N
XLogP2.38
TPSA57.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-N-butan-2-yl-2-N,4-N,4-N-triethyl-6-N-methyl-1,3,5-triazine-2,4,6-triamine with MolForge

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Launch Full Analysis

Related Compounds

2-N,4-N,4-N-triethyl-6-N-methyl-2-N-(2-methylbutyl)-1,3,5-triazine-2,4,6-triamine
CID 80836449
2-N,2-N-diethyl-4-N,6-N-dimethyl-4-N-(3-methylbutan-2-yl)-1,3,5-triazine-2,4,6-triamine
CID 80792678
4-N-tert-butyl-2-N,2-N-diethyl-6-N-methyl-1,3,5-triazine-2,4,6-triamine
CID 80768855
2-N,2-N-diethyl-4-N-[1-(furan-2-yl)ethyl]-6-N-methyl-1,3,5-triazine-2,4,6-triamine
CID 80773788
2-N-ethyl-4-N,4-N,6-N-trimethyl-2-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80773692
2-N,2-N-diethyl-4-N-(1-methoxy-3-methylbutan-2-yl)-6-N-methyl-1,3,5-triazine-2,4,6-triamine
CID 80827536
3-[[4-(diethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]propane-1,2-diol
CID 80851247
2-N,2-N-diethyl-4-N-methyl-6-[(2-methylpropan-2-yl)oxy]-1,3,5-triazine-2,4-diamine
CID 80862256
2-N-butan-2-yl-6-chloro-2-N-ethyl-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 55125314
2-N-butan-2-yl-4-N,4-N-diethyl-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4,6-triamine
CID 80787377
N-butan-2-yl-N-ethyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80894423
4-N-(cyclopentylmethyl)-2-N,2-N-diethyl-4-N,6-N-dimethyl-1,3,5-triazine-2,4,6-triamine
CID 80816084

Frequently Asked Questions

What is the IUPAC name of 2-N-butan-2-yl-2-N,4-N,4-N-triethyl-6-N-methyl-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N-butan-2-yl-2-N,4-N,4-N-triethyl-6-N-methyl-1,3,5-triazine-2,4,6-triamine (CID 80783122) is 2-N-butan-2-yl-2-N,4-N,4-N-triethyl-6-N-methyl-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N-butan-2-yl-2-N,4-N,4-N-triethyl-6-N-methyl-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N-butan-2-yl-2-N,4-N,4-N-triethyl-6-N-methyl-1,3,5-triazine-2,4,6-triamine is CCC(C)N(CC)c1nc(NC)nc(N(CC)CC)n1.
What is the InChIKey of 2-N-butan-2-yl-2-N,4-N,4-N-triethyl-6-N-methyl-1,3,5-triazine-2,4,6-triamine?
The InChIKey is ZQYNQVKDTJFYTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N6/c1-7-11(5)20(10-4)14-17-12(15-6)16-13(18-14)19(8-2)9-3/h11H,7-10H2,1-6H3,(H,15,16,17,18).
What are the key properties of 2-N-butan-2-yl-2-N,4-N,4-N-triethyl-6-N-methyl-1,3,5-triazine-2,4,6-triamine?
2-N-butan-2-yl-2-N,4-N,4-N-triethyl-6-N-methyl-1,3,5-triazine-2,4,6-triamine has a molecular weight of 280.42 g/mol, XLogP of 2.38, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-butan-2-yl-2-N,4-N,4-N-triethyl-6-N-methyl-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 80783122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).