2-N,2-N-dimethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)-1,3,5-triazine-2,4-diamine

C14H18N6 — CID 79740503

IUPAC2-N,2-N-dimethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)-1,3,5-triazine-2,4-diamine
SMILESCN(C)c1nc(N)nc(C2CCCc3cccnc32)n1
InChIInChI=1S/C14H18N6/c1-20(2)14-18-12(17-13(15)19-14)10-7-3-5-9-6-4-8-16-11(9)10/h4,6,8,10H,3,5,7H2,1-2H3,(H2,15,17,18,19)
InChIKeyQUFLPVLCHUKCAT-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.38
Rot. Bonds2

About 2-N,2-N-dimethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)-1,3,5-triazine-2,4-diamine

2-N,2-N-dimethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)-1,3,5-triazine-2,4-diamine (PubChem CID 79740503) has the molecular formula C14H18N6 and a molecular weight of 270.34 g/mol. Its IUPAC name is 2-N,2-N-dimethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N,2-N-dimethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)-1,3,5-triazine-2,4-diamine
PubChem CID79740503
Molecular FormulaC14H18N6
Molecular Weight270.34 g/mol
Exact Mass270.16
IUPAC Name2-N,2-N-dimethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)-1,3,5-triazine-2,4-diamine
SMILESCN(C)c1nc(N)nc(C2CCCc3cccnc32)n1
InChIInChI=1S/C14H18N6/c1-20(2)14-18-12(17-13(15)19-14)10-7-3-5-9-6-4-8-16-11(9)10/h4,6,8,10H,3,5,7H2,1-2H3,(H2,15,17,18,19)
InChIKeyQUFLPVLCHUKCAT-UHFFFAOYSA-N
XLogP1.38
TPSA80.82 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-dimethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N,2-N-dimethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)-1,3,5-triazine-2,4-diamine (CID 79740503) is 2-N,2-N-dimethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N,2-N-dimethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N,2-N-dimethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)-1,3,5-triazine-2,4-diamine is CN(C)c1nc(N)nc(C2CCCc3cccnc32)n1.
What is the InChIKey of 2-N,2-N-dimethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)-1,3,5-triazine-2,4-diamine?
The InChIKey is QUFLPVLCHUKCAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N6/c1-20(2)14-18-12(17-13(15)19-14)10-7-3-5-9-6-4-8-16-11(9)10/h4,6,8,10H,3,5,7H2,1-2H3,(H2,15,17,18,19).
What are the key properties of 2-N,2-N-dimethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)-1,3,5-triazine-2,4-diamine?
2-N,2-N-dimethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)-1,3,5-triazine-2,4-diamine has a molecular weight of 270.34 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-dimethyl-6-(5,6,7,8-tetrahydroquinolin-8-yl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 79740503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).