1-(3-methylbutan-2-yl)-5-pentan-2-yl-4H-imidazo[4,5-d]pyrazole

C14H24N4 — CID 135966342

IUPAC1-(3-methylbutan-2-yl)-5-pentan-2-yl-4H-imidazo[4,5-d]pyrazole
SMILESCCCC(C)c1nc2c(cnn2C(C)C(C)C)[nH]1
InChIInChI=1S/C14H24N4/c1-6-7-10(4)13-16-12-8-15-18(14(12)17-13)11(5)9(2)3/h8-11H,6-7H2,1-5H3,(H,16,17)
InChIKeyVTMGZWVZVKQCDO-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.88
Rot. Bonds5

About 1-(3-methylbutan-2-yl)-5-pentan-2-yl-4H-imidazo[4,5-d]pyrazole

1-(3-methylbutan-2-yl)-5-pentan-2-yl-4H-imidazo[4,5-d]pyrazole (PubChem CID 135966342) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-(3-methylbutan-2-yl)-5-pentan-2-yl-4H-imidazo[4,5-d]pyrazole.

Molecular Properties

Compound Name1-(3-methylbutan-2-yl)-5-pentan-2-yl-4H-imidazo[4,5-d]pyrazole
PubChem CID135966342
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name1-(3-methylbutan-2-yl)-5-pentan-2-yl-4H-imidazo[4,5-d]pyrazole
SMILESCCCC(C)c1nc2c(cnn2C(C)C(C)C)[nH]1
InChIInChI=1S/C14H24N4/c1-6-7-10(4)13-16-12-8-15-18(14(12)17-13)11(5)9(2)3/h8-11H,6-7H2,1-5H3,(H,16,17)
InChIKeyVTMGZWVZVKQCDO-UHFFFAOYSA-N
XLogP3.88
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(3-methylbutan-2-yl)-5-pentan-2-yl-4H-imidazo[4,5-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

1-ethyl-5-(5-methyl-1-propyl-1H-pyrazol-4-yl)-1,4-dihydroimidazo[4,5-c]pyrazole
CID 135966217
1-ethyl-5-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-1,4-dihydroimidazo[4,5-c]pyrazole
CID 135966314
Dihydroimidazopyrazole
CID 135621748
1-isopropyl-3-methyl-5-(1-methyl-1H-imidazol-5-yl)-1,4-dihydroimidazo[4,5-c]pyrazole
CID 135888202
5-(1,2-dimethyl-1H-imidazol-5-yl)-1-methyl-1,4-dihydroimidazo[4,5-c]pyrazole
CID 135888559
5-(1,2-dimethyl-1H-imidazol-5-yl)-3-methyl-1-(3-methylbutyl)-1,4-dihydroimidazo[4,5-c]pyrazole
CID 135914450
5-[1,1-Dimethyl-2-(4-morpholinyl)ethyl]-1-methyl-1,4-dihydroimidazo[4,5-c]pyrazole
CID 135952169
5-(2,2-Dimethylpropyl)-1-isobutyl-1,4-dihydroimidazo[4,5-c]pyrazole
CID 135966200
5-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-1-methyl-1,4-dihydroimidazo[4,5-c]pyrazole
CID 135966254
5-(2,2-dimethylpropyl)-1-[(2S)-3-methylbutan-2-yl]-4H-imidazo[4,5-d]pyrazole
CID 136902568
1-[[(1S)-cyclohex-3-en-1-yl]methyl]-5-(2,3-dimethylimidazol-4-yl)-4H-imidazo[4,5-d]pyrazole
CID 164630604
1-[(1S)-1-cyclopropylethyl]-5-(1-methylimidazol-2-yl)-4H-imidazo[4,5-d]pyrazole
CID 164638900

Frequently Asked Questions

What is the IUPAC name of 1-(3-methylbutan-2-yl)-5-pentan-2-yl-4H-imidazo[4,5-d]pyrazole?
The IUPAC name of 1-(3-methylbutan-2-yl)-5-pentan-2-yl-4H-imidazo[4,5-d]pyrazole (CID 135966342) is 1-(3-methylbutan-2-yl)-5-pentan-2-yl-4H-imidazo[4,5-d]pyrazole.
What is the SMILES notation for 1-(3-methylbutan-2-yl)-5-pentan-2-yl-4H-imidazo[4,5-d]pyrazole?
The canonical SMILES for 1-(3-methylbutan-2-yl)-5-pentan-2-yl-4H-imidazo[4,5-d]pyrazole is CCCC(C)c1nc2c(cnn2C(C)C(C)C)[nH]1.
What is the InChIKey of 1-(3-methylbutan-2-yl)-5-pentan-2-yl-4H-imidazo[4,5-d]pyrazole?
The InChIKey is VTMGZWVZVKQCDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-6-7-10(4)13-16-12-8-15-18(14(12)17-13)11(5)9(2)3/h8-11H,6-7H2,1-5H3,(H,16,17).
What are the key properties of 1-(3-methylbutan-2-yl)-5-pentan-2-yl-4H-imidazo[4,5-d]pyrazole?
1-(3-methylbutan-2-yl)-5-pentan-2-yl-4H-imidazo[4,5-d]pyrazole has a molecular weight of 248.37 g/mol, XLogP of 3.88, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylbutan-2-yl)-5-pentan-2-yl-4H-imidazo[4,5-d]pyrazole is sourced from PubChem (CID 135966342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).