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

C11H21N5 — CID 143196294

IUPACethane;1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine
SMILESCC.Cc1cn2nc(C)n(N(C)C)c2c1N
InChIInChI=1S/C9H15N5.C2H6/c1-6-5-13-9(8(6)10)14(12(3)4)7(2)11-13;1-2/h5H,10H2,1-4H3;1-2H3
InChIKeyRTXKKZNPTYLEFN-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.56
Rot. Bonds1

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

ethane;1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine (PubChem CID 143196294) has the molecular formula C11H21N5 and a molecular weight of 223.32 g/mol. Its IUPAC name is ethane;1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine.

Molecular Properties

Compound Nameethane;1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine
PubChem CID143196294
Molecular FormulaC11H21N5
Molecular Weight223.32 g/mol
Exact Mass223.18
IUPAC Nameethane;1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine
SMILESCC.Cc1cn2nc(C)n(N(C)C)c2c1N
InChIInChI=1S/C9H15N5.C2H6/c1-6-5-13-9(8(6)10)14(12(3)4)7(2)11-13;1-2/h5H,10H2,1-4H3;1-2H3
InChIKeyRTXKKZNPTYLEFN-UHFFFAOYSA-N
XLogP1.56
TPSA51.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze ethane;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

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
1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine
CID 58607304
6-isocyano-7-methyl-3H-pyrrolo[2,1-e]tetrazole
CID 58880679
N-[2-methyl-4-(1-methyl-1H-pyrazol-4-yl)-1H-imidazol-1-yl]imidoformamide
CID 68181950
1-N,1-N-diethylimidazo[1,5-b]pyrazole-1,4,6-triamine
CID 69253967

Frequently Asked Questions

What is the IUPAC name of ethane;1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine?
The IUPAC name of ethane;1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine (CID 143196294) is ethane;1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine.
What is the SMILES notation for ethane;1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine?
The canonical SMILES for ethane;1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine is CC.Cc1cn2nc(C)n(N(C)C)c2c1N.
What is the InChIKey of ethane;1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine?
The InChIKey is RTXKKZNPTYLEFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5.C2H6/c1-6-5-13-9(8(6)10)14(12(3)4)7(2)11-13;1-2/h5H,10H2,1-4H3;1-2H3.
What are the key properties of ethane;1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine?
ethane;1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine has a molecular weight of 223.32 g/mol, XLogP of 1.56, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-N,1-N,2,6-tetramethylpyrrolo[1,2-b][1,2,4]triazole-1,7-diamine is sourced from PubChem (CID 143196294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).