1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine

C9H15N5 — CID 58607304

IUPAC1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine
SMILESCc1cn2nc(C)n(N(C)C)c2c1N
InChIInChI=1S/C9H15N5/c1-6-5-13-9(8(6)10)14(12(3)4)7(2)11-13/h5H,10H2,1-4H3
InChIKeyWRAILJXILHHYGI-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.53
Rot. Bonds1

About 1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine

1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine (PubChem CID 58607304) has the molecular formula C9H15N5 and a molecular weight of 193.25 g/mol. Its IUPAC name is 1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine.

Molecular Properties

Compound Name1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine
PubChem CID58607304
Molecular FormulaC9H15N5
Molecular Weight193.25 g/mol
Exact Mass193.13
IUPAC Name1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine
SMILESCc1cn2nc(C)n(N(C)C)c2c1N
InChIInChI=1S/C9H15N5/c1-6-5-13-9(8(6)10)14(12(3)4)7(2)11-13/h5H,10H2,1-4H3
InChIKeyWRAILJXILHHYGI-UHFFFAOYSA-N
XLogP0.53
TPSA51.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6,7-dimethyl-5H-imidazo[1,2-b]pyrazole
CID 14344171
2,6-dimethyl-5H-imidazo[1,2-b]pyrazol-7-amine
CID 17786210
3,6,7-trimethyl-5H-imidazo[1,2-b]pyrazole
CID 18725112
6-isocyano-2-methyl-3H-pyrrolo[1,2-b][1,2,4]triazole-7-carbonitrile
CID 20578661
2,6,7-trimethyl-3H-pyrrolo[1,2-b][1,2,4]triazole
CID 22976819
1,6-Dimethyl-1H-imidazo[1,2-b]pyrazol-7-amine
CID 45078689
1-Hydroxypyrrolo[1,2-b][1,2,4]triazol-7-amine
CID 55285783
1,2,6,7-Tetramethylpyrrolo[1,2-b][1,2,4]triazole
CID 57684247
N,N,2,6-tetramethyl-7-nitrosopyrrolo[1,2-b][1,2,4]triazol-1-amine
CID 58607302
N,N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazol-1-amine
CID 58607303
6-isocyano-7-methyl-3H-pyrrolo[2,1-e]tetrazole
CID 58880679
1,6-Dimethylimidazo[2,1-e]pyrazol-7-amine;dihydrochloride
CID 67782905

Frequently Asked Questions

What is the IUPAC name of 1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine?
The IUPAC name of 1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine (CID 58607304) is 1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine.
What is the SMILES notation for 1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine?
The canonical SMILES for 1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine is Cc1cn2nc(C)n(N(C)C)c2c1N.
What is the InChIKey of 1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine?
The InChIKey is WRAILJXILHHYGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5/c1-6-5-13-9(8(6)10)14(12(3)4)7(2)11-13/h5H,10H2,1-4H3.
What are the key properties of 1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine?
1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine has a molecular weight of 193.25 g/mol, XLogP of 0.53, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine is sourced from PubChem (CID 58607304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).