5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole

C11H19N3O — CID 118489250

IUPAC5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole
SMILESCOCCN1Cc2[nH]nc(C(C)C)c2C1
InChIInChI=1S/C11H19N3O/c1-8(2)11-9-6-14(4-5-15-3)7-10(9)12-13-11/h8H,4-7H2,1-3H3,(H,12,13)
InChIKeyJGHSZICSGNZAOO-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.50
Rot. Bonds4

About 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole

5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole (PubChem CID 118489250) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole.

Molecular Properties

Compound Name5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole
PubChem CID118489250
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole
SMILESCOCCN1Cc2[nH]nc(C(C)C)c2C1
InChIInChI=1S/C11H19N3O/c1-8(2)11-9-6-14(4-5-15-3)7-10(9)12-13-11/h8H,4-7H2,1-3H3,(H,12,13)
InChIKeyJGHSZICSGNZAOO-UHFFFAOYSA-N
XLogP1.50
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole 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-propan-2-yl-5-(2,2,2-trifluoroethyl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazole
CID 118489287
3-propan-2-yl-5-(3,3,3-trifluoropropyl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazole
CID 118489372
3,3,3-trifluoro-1-(3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-5-yl)propan-1-one
CID 130378123
3,5-dimethyl-4-[1-[2-(2,2,2-trifluoroethoxy)ethyl]pyrrolidin-2-yl]-1H-pyrazole
CID 137844544
1-({1H,4H,5H,6H-cyclopenta[c]pyrazol-3-yl}methyl)-3-methoxy-3-(trifluoromethyl)pyrrolidine
CID 171690223
1-({4-[(5-Cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]piperazin-1-yl}methyl)isoquinoline
CID 172004857
6-Methylidene-3,4,5-tri(propan-2-yl)-2,4-dihydropyrrolo[3,4-c]pyrazole
CID 58045286
2-[[3,4-bis(2-aminoethyl)-1H-pyrazol-5-yl]methylamino]ethanol
CID 69019245
3-Ethyl-1,4,5,6-tetrahydropyrrolo[3,4-c]pyrazole
CID 83845377
3-Propan-2-yl-1,4,5,6-tetrahydropyrrolo[3,4-d]pyrazole
CID 83845508
3-Tert-butyl-1,4,5,6-tetrahydropyrrolo[3,4-d]pyrazole
CID 83845835
1-(3-ethyl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazol-5-yl)-3-methylbutan-1-one
CID 117611717

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole?
The IUPAC name of 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole (CID 118489250) is 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole.
What is the SMILES notation for 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole?
The canonical SMILES for 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole is COCCN1Cc2[nH]nc(C(C)C)c2C1.
What is the InChIKey of 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole?
The InChIKey is JGHSZICSGNZAOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-8(2)11-9-6-14(4-5-15-3)7-10(9)12-13-11/h8H,4-7H2,1-3H3,(H,12,13).
What are the key properties of 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole?
5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole has a molecular weight of 209.29 g/mol, XLogP of 1.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxyethyl)-3-propan-2-yl-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole is sourced from PubChem (CID 118489250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).