3-ethyl-6-[2-[ethyl(methyl)amino]ethyl]-1-methylimidazo[4,5-d]pyrazol-5-amine

C12H22N6 — CID 79299715

IUPAC3-ethyl-6-[2-[ethyl(methyl)amino]ethyl]-1-methylimidazo[4,5-d]pyrazol-5-amine
SMILESCCc1nn(C)c2c1nc(N)n2CCN(C)CC
InChIInChI=1S/C12H22N6/c1-5-9-10-11(17(4)15-9)18(12(13)14-10)8-7-16(3)6-2/h5-8H2,1-4H3,(H2,13,14)
InChIKeySDMRLAMJKIYASZ-UHFFFAOYSA-N
MW250.35 g/mol
LogP0.87
Rot. Bonds5

About 3-ethyl-6-[2-[ethyl(methyl)amino]ethyl]-1-methylimidazo[4,5-d]pyrazol-5-amine

3-ethyl-6-[2-[ethyl(methyl)amino]ethyl]-1-methylimidazo[4,5-d]pyrazol-5-amine (PubChem CID 79299715) has the molecular formula C12H22N6 and a molecular weight of 250.35 g/mol. Its IUPAC name is 3-ethyl-6-[2-[ethyl(methyl)amino]ethyl]-1-methylimidazo[4,5-d]pyrazol-5-amine.

Molecular Properties

Compound Name3-ethyl-6-[2-[ethyl(methyl)amino]ethyl]-1-methylimidazo[4,5-d]pyrazol-5-amine
PubChem CID79299715
Molecular FormulaC12H22N6
Molecular Weight250.35 g/mol
Exact Mass250.19
IUPAC Name3-ethyl-6-[2-[ethyl(methyl)amino]ethyl]-1-methylimidazo[4,5-d]pyrazol-5-amine
SMILESCCc1nn(C)c2c1nc(N)n2CCN(C)CC
InChIInChI=1S/C12H22N6/c1-5-9-10-11(17(4)15-9)18(12(13)14-10)8-7-16(3)6-2/h5-8H2,1-4H3,(H2,13,14)
InChIKeySDMRLAMJKIYASZ-UHFFFAOYSA-N
XLogP0.87
TPSA64.90 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-ethyl-6-[2-[ethyl(methyl)amino]ethyl]-1-methylimidazo[4,5-d]pyrazol-5-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-6-[2-[ethyl(methyl)amino]ethyl]-1-methylimidazo[4,5-d]pyrazol-5-amine?
The IUPAC name of 3-ethyl-6-[2-[ethyl(methyl)amino]ethyl]-1-methylimidazo[4,5-d]pyrazol-5-amine (CID 79299715) is 3-ethyl-6-[2-[ethyl(methyl)amino]ethyl]-1-methylimidazo[4,5-d]pyrazol-5-amine.
What is the SMILES notation for 3-ethyl-6-[2-[ethyl(methyl)amino]ethyl]-1-methylimidazo[4,5-d]pyrazol-5-amine?
The canonical SMILES for 3-ethyl-6-[2-[ethyl(methyl)amino]ethyl]-1-methylimidazo[4,5-d]pyrazol-5-amine is CCc1nn(C)c2c1nc(N)n2CCN(C)CC.
What is the InChIKey of 3-ethyl-6-[2-[ethyl(methyl)amino]ethyl]-1-methylimidazo[4,5-d]pyrazol-5-amine?
The InChIKey is SDMRLAMJKIYASZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N6/c1-5-9-10-11(17(4)15-9)18(12(13)14-10)8-7-16(3)6-2/h5-8H2,1-4H3,(H2,13,14).
What are the key properties of 3-ethyl-6-[2-[ethyl(methyl)amino]ethyl]-1-methylimidazo[4,5-d]pyrazol-5-amine?
3-ethyl-6-[2-[ethyl(methyl)amino]ethyl]-1-methylimidazo[4,5-d]pyrazol-5-amine has a molecular weight of 250.35 g/mol, XLogP of 0.87, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-6-[2-[ethyl(methyl)amino]ethyl]-1-methylimidazo[4,5-d]pyrazol-5-amine is sourced from PubChem (CID 79299715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).