2-N,2-N,4-N-trimethyl-6-(3-propyltriazol-4-yl)-1,3,5-triazine-2,4-diamine

C11H18N8 — CID 114691086

IUPAC2-N,2-N,4-N-trimethyl-6-(3-propyltriazol-4-yl)-1,3,5-triazine-2,4-diamine
SMILESCCCn1nncc1-c1nc(NC)nc(N(C)C)n1
InChIInChI=1S/C11H18N8/c1-5-6-19-8(7-13-17-19)9-14-10(12-2)16-11(15-9)18(3)4/h7H,5-6H2,1-4H3,(H,12,14,15,16)
InChIKeyXHZAROMOSCBZPT-UHFFFAOYSA-N
MW262.32 g/mol
LogP0.65
Rot. Bonds5

About 2-N,2-N,4-N-trimethyl-6-(3-propyltriazol-4-yl)-1,3,5-triazine-2,4-diamine

2-N,2-N,4-N-trimethyl-6-(3-propyltriazol-4-yl)-1,3,5-triazine-2,4-diamine (PubChem CID 114691086) has the molecular formula C11H18N8 and a molecular weight of 262.32 g/mol. Its IUPAC name is 2-N,2-N,4-N-trimethyl-6-(3-propyltriazol-4-yl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N,2-N,4-N-trimethyl-6-(3-propyltriazol-4-yl)-1,3,5-triazine-2,4-diamine
PubChem CID114691086
Molecular FormulaC11H18N8
Molecular Weight262.32 g/mol
Exact Mass262.17
IUPAC Name2-N,2-N,4-N-trimethyl-6-(3-propyltriazol-4-yl)-1,3,5-triazine-2,4-diamine
SMILESCCCn1nncc1-c1nc(NC)nc(N(C)C)n1
InChIInChI=1S/C11H18N8/c1-5-6-19-8(7-13-17-19)9-14-10(12-2)16-11(15-9)18(3)4/h7H,5-6H2,1-4H3,(H,12,14,15,16)
InChIKeyXHZAROMOSCBZPT-UHFFFAOYSA-N
XLogP0.65
TPSA84.65 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.32
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 2-N,2-N,4-N-trimethyl-6-(3-propyltriazol-4-yl)-1,3,5-triazine-2,4-diamine with MolForge

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Related Compounds

4-ethoxy-N-methyl-6-(3-propyltriazol-4-yl)-1,3,5-triazin-2-amine
CID 114691121
4-N-ethyl-2-N,2-N-dimethyl-6-(3-methyltriazol-4-yl)-1,3,5-triazine-2,4-diamine
CID 114690853
N-methyl-3-(3-propyltriazol-4-yl)pyrazin-2-amine
CID 114691130
2-N,2-N-dimethyl-6-(3-methyltriazol-4-yl)-1,3,5-triazine-2,4-diamine
CID 114690875
2-N,2-N,4-N-trimethyl-6-propylsulfanyl-1,3,5-triazine-2,4-diamine
CID 80887563
2-N,2-N,4-N-trimethyl-6-(3-methylthiophen-2-yl)-1,3,5-triazine-2,4-diamine
CID 79991346
4-piperidin-1-yl-6-(3-propyltriazol-4-yl)-1,3,5-triazin-2-amine
CID 114691144
2-N,2-N,6-N-trimethyl-4-N-(1-propylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
CID 80783238
4-(3-propyltriazol-4-yl)aniline
CID 82205210
2-N-ethyl-4-N,4-N,6-N-trimethyl-2-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80773692
5-fluoro-4-(3-propyltriazol-4-yl)pyrimidin-2-amine
CID 114691134
4-chloro-2-ethyl-5-methyl-6-(3-propyltriazol-4-yl)pyrimidine
CID 114690776

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,4-N-trimethyl-6-(3-propyltriazol-4-yl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N,2-N,4-N-trimethyl-6-(3-propyltriazol-4-yl)-1,3,5-triazine-2,4-diamine (CID 114691086) is 2-N,2-N,4-N-trimethyl-6-(3-propyltriazol-4-yl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N,2-N,4-N-trimethyl-6-(3-propyltriazol-4-yl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N,2-N,4-N-trimethyl-6-(3-propyltriazol-4-yl)-1,3,5-triazine-2,4-diamine is CCCn1nncc1-c1nc(NC)nc(N(C)C)n1.
What is the InChIKey of 2-N,2-N,4-N-trimethyl-6-(3-propyltriazol-4-yl)-1,3,5-triazine-2,4-diamine?
The InChIKey is XHZAROMOSCBZPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N8/c1-5-6-19-8(7-13-17-19)9-14-10(12-2)16-11(15-9)18(3)4/h7H,5-6H2,1-4H3,(H,12,14,15,16).
What are the key properties of 2-N,2-N,4-N-trimethyl-6-(3-propyltriazol-4-yl)-1,3,5-triazine-2,4-diamine?
2-N,2-N,4-N-trimethyl-6-(3-propyltriazol-4-yl)-1,3,5-triazine-2,4-diamine has a molecular weight of 262.32 g/mol, XLogP of 0.65, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,4-N-trimethyl-6-(3-propyltriazol-4-yl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 114691086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).