6-(3,5-dimethylpyrazol-1-yl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine

C10H15N7 — CID 80853433

IUPAC6-(3,5-dimethylpyrazol-1-yl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
SMILESCc1cc(C)n(-c2nc(N)nc(N(C)C)n2)n1
InChIInChI=1S/C10H15N7/c1-6-5-7(2)17(15-6)10-13-8(11)12-9(14-10)16(3)4/h5H,1-4H3,(H2,11,12,13,14)
InChIKeyLYZGURNSIAPRDK-UHFFFAOYSA-N
MW233.28 g/mol
LogP0.32
Rot. Bonds2

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

6-(3,5-dimethylpyrazol-1-yl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine (PubChem CID 80853433) has the molecular formula C10H15N7 and a molecular weight of 233.28 g/mol. Its IUPAC name is 6-(3,5-dimethylpyrazol-1-yl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-(3,5-dimethylpyrazol-1-yl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
PubChem CID80853433
Molecular FormulaC10H15N7
Molecular Weight233.28 g/mol
Exact Mass233.14
IUPAC Name6-(3,5-dimethylpyrazol-1-yl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
SMILESCc1cc(C)n(-c2nc(N)nc(N(C)C)n2)n1
InChIInChI=1S/C10H15N7/c1-6-5-7(2)17(15-6)10-13-8(11)12-9(14-10)16(3)4/h5H,1-4H3,(H2,11,12,13,14)
InChIKeyLYZGURNSIAPRDK-UHFFFAOYSA-N
XLogP0.32
TPSA85.75 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.28
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-(3,5-dimethylpyrazol-1-yl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-(3,5-dimethylpyrazol-1-yl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine (CID 80853433) is 6-(3,5-dimethylpyrazol-1-yl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-(3,5-dimethylpyrazol-1-yl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-(3,5-dimethylpyrazol-1-yl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine is Cc1cc(C)n(-c2nc(N)nc(N(C)C)n2)n1.
What is the InChIKey of 6-(3,5-dimethylpyrazol-1-yl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine?
The InChIKey is LYZGURNSIAPRDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N7/c1-6-5-7(2)17(15-6)10-13-8(11)12-9(14-10)16(3)4/h5H,1-4H3,(H2,11,12,13,14).
What are the key properties of 6-(3,5-dimethylpyrazol-1-yl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine?
6-(3,5-dimethylpyrazol-1-yl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine has a molecular weight of 233.28 g/mol, XLogP of 0.32, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-dimethylpyrazol-1-yl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80853433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).