5-cyclohexyl-1-propyl-4H-imidazo[4,5-d]pyrazole

C13H20N4 — CID 135892905

IUPAC5-cyclohexyl-1-propyl-4H-imidazo[4,5-d]pyrazole
SMILESCCCn1ncc2[nH]c(C3CCCCC3)nc21
InChIInChI=1S/C13H20N4/c1-2-8-17-13-11(9-14-17)15-12(16-13)10-6-4-3-5-7-10/h9-10H,2-8H2,1H3,(H,15,16)
InChIKeyKKZDIHXODPSANR-UHFFFAOYSA-N
MW232.33 g/mol
LogP3.22
Rot. Bonds3

About 5-cyclohexyl-1-propyl-4H-imidazo[4,5-d]pyrazole

5-cyclohexyl-1-propyl-4H-imidazo[4,5-d]pyrazole (PubChem CID 135892905) has the molecular formula C13H20N4 and a molecular weight of 232.33 g/mol. Its IUPAC name is 5-cyclohexyl-1-propyl-4H-imidazo[4,5-d]pyrazole.

Molecular Properties

Compound Name5-cyclohexyl-1-propyl-4H-imidazo[4,5-d]pyrazole
PubChem CID135892905
Molecular FormulaC13H20N4
Molecular Weight232.33 g/mol
Exact Mass232.17
IUPAC Name5-cyclohexyl-1-propyl-4H-imidazo[4,5-d]pyrazole
SMILESCCCn1ncc2[nH]c(C3CCCCC3)nc21
InChIInChI=1S/C13H20N4/c1-2-8-17-13-11(9-14-17)15-12(16-13)10-6-4-3-5-7-10/h9-10H,2-8H2,1H3,(H,15,16)
InChIKeyKKZDIHXODPSANR-UHFFFAOYSA-N
XLogP3.22
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-cyclohexyl-1-propyl-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

8-cyclopropyl-3-propyl-7H-purine-2-thione
CID 140997960
6-(cyclohexylmethyl)-1-propyl-5H-pyrazolo[5,4-d]pyrimidin-4-one
CID 142874925
8-cyclopentyl-1,3-dipropyl-6-sulfanylidene-7H-purin-2-one
CID 19382381
4-bromo-5-(3-chlorocycloheptyl)-1-propylpyrazole
CID 114665248
1-(4-chloro-1-propylpyrazol-5-yl)-2-cyclohexylethane-1,2-diol
CID 103459015
6-chloro-2-cyclohexyl-1H-imidazo[4,5-b]pyridine
CID 82142257
8-cyclopentyl-6-methylsulfanyl-3-propyl-7H-purin-2-one
CID 10469601
5,6-dichloro-2-cycloheptyl-1H-benzimidazole
CID 82004587
8-cyclopentyl-3-methyl-6-propyl-9H-[1,2,4]triazolo[3,4-f]purin-5-one
CID 135702819
3-(4-aminobutyl)-8-cyclopentyl-1-propyl-7H-purine-2,6-dione
CID 19699230
2-cycloheptyl-5-ethoxy-1H-imidazo[4,5-b]pyridine
CID 79816213
4-bromo-5-(2-chlorocycloheptyl)-1-propylpyrazole
CID 114662563

Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-1-propyl-4H-imidazo[4,5-d]pyrazole?
The IUPAC name of 5-cyclohexyl-1-propyl-4H-imidazo[4,5-d]pyrazole (CID 135892905) is 5-cyclohexyl-1-propyl-4H-imidazo[4,5-d]pyrazole.
What is the SMILES notation for 5-cyclohexyl-1-propyl-4H-imidazo[4,5-d]pyrazole?
The canonical SMILES for 5-cyclohexyl-1-propyl-4H-imidazo[4,5-d]pyrazole is CCCn1ncc2[nH]c(C3CCCCC3)nc21.
What is the InChIKey of 5-cyclohexyl-1-propyl-4H-imidazo[4,5-d]pyrazole?
The InChIKey is KKZDIHXODPSANR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4/c1-2-8-17-13-11(9-14-17)15-12(16-13)10-6-4-3-5-7-10/h9-10H,2-8H2,1H3,(H,15,16).
What are the key properties of 5-cyclohexyl-1-propyl-4H-imidazo[4,5-d]pyrazole?
5-cyclohexyl-1-propyl-4H-imidazo[4,5-d]pyrazole has a molecular weight of 232.33 g/mol, XLogP of 3.22, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-1-propyl-4H-imidazo[4,5-d]pyrazole is sourced from PubChem (CID 135892905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).