3-N,3-N,5-N,5-N-tetramethyl-1H-1,2,4-triazole-3,5-diamine

C6H13N5 — CID 5188367

IUPAC3-N,3-N,5-N,5-N-tetramethyl-1H-1,2,4-triazole-3,5-diamine
SMILESCN(C)c1n[nH]c(N(C)C)n1
InChIInChI=1S/C6H13N5/c1-10(2)5-7-6(9-8-5)11(3)4/h1-4H3,(H,7,8,9)
InChIKeyJJGXKXPPLXDJBG-UHFFFAOYSA-N
MW155.20 g/mol
LogP-0.06
Rot. Bonds2

About 3-N,3-N,5-N,5-N-tetramethyl-1H-1,2,4-triazole-3,5-diamine

3-N,3-N,5-N,5-N-tetramethyl-1H-1,2,4-triazole-3,5-diamine (PubChem CID 5188367) has the molecular formula C6H13N5 and a molecular weight of 155.20 g/mol. Its IUPAC name is 3-N,3-N,5-N,5-N-tetramethyl-1H-1,2,4-triazole-3,5-diamine.

Molecular Properties

Compound Name3-N,3-N,5-N,5-N-tetramethyl-1H-1,2,4-triazole-3,5-diamine
PubChem CID5188367
Molecular FormulaC6H13N5
Molecular Weight155.20 g/mol
Exact Mass155.12
IUPAC Name3-N,3-N,5-N,5-N-tetramethyl-1H-1,2,4-triazole-3,5-diamine
SMILESCN(C)c1n[nH]c(N(C)C)n1
InChIInChI=1S/C6H13N5/c1-10(2)5-7-6(9-8-5)11(3)4/h1-4H3,(H,7,8,9)
InChIKeyJJGXKXPPLXDJBG-UHFFFAOYSA-N
XLogP-0.06
TPSA48.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 5-0.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-N,3-N,5-N,5-N-tetramethyl-1H-1,2,4-triazole-3,5-diamine?
The IUPAC name of 3-N,3-N,5-N,5-N-tetramethyl-1H-1,2,4-triazole-3,5-diamine (CID 5188367) is 3-N,3-N,5-N,5-N-tetramethyl-1H-1,2,4-triazole-3,5-diamine.
What is the SMILES notation for 3-N,3-N,5-N,5-N-tetramethyl-1H-1,2,4-triazole-3,5-diamine?
The canonical SMILES for 3-N,3-N,5-N,5-N-tetramethyl-1H-1,2,4-triazole-3,5-diamine is CN(C)c1n[nH]c(N(C)C)n1.
What is the InChIKey of 3-N,3-N,5-N,5-N-tetramethyl-1H-1,2,4-triazole-3,5-diamine?
The InChIKey is JJGXKXPPLXDJBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N5/c1-10(2)5-7-6(9-8-5)11(3)4/h1-4H3,(H,7,8,9).
What are the key properties of 3-N,3-N,5-N,5-N-tetramethyl-1H-1,2,4-triazole-3,5-diamine?
3-N,3-N,5-N,5-N-tetramethyl-1H-1,2,4-triazole-3,5-diamine has a molecular weight of 155.20 g/mol, XLogP of -0.06, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,3-N,5-N,5-N-tetramethyl-1H-1,2,4-triazole-3,5-diamine is sourced from PubChem (CID 5188367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).