1-(4,5-dihydro-1H-imidazol-2-yl)-3,5-diethylpyrazole

C10H16N4 — CID 3332278

IUPAC1-(4,5-dihydro-1H-imidazol-2-yl)-3,5-diethylpyrazole
SMILESCCc1cc(CC)n(C2=NCCN2)n1
InChIInChI=1S/C10H16N4/c1-3-8-7-9(4-2)14(13-8)10-11-5-6-12-10/h7H,3-6H2,1-2H3,(H,11,12)
InChIKeyLTXGXBWHFPPXEG-UHFFFAOYSA-N
MW192.27 g/mol
LogP0.82
Rot. Bonds2

About 1-(4,5-dihydro-1H-imidazol-2-yl)-3,5-diethylpyrazole

1-(4,5-dihydro-1H-imidazol-2-yl)-3,5-diethylpyrazole (PubChem CID 3332278) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is 1-(4,5-dihydro-1H-imidazol-2-yl)-3,5-diethylpyrazole.

Molecular Properties

Compound Name1-(4,5-dihydro-1H-imidazol-2-yl)-3,5-diethylpyrazole
PubChem CID3332278
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name1-(4,5-dihydro-1H-imidazol-2-yl)-3,5-diethylpyrazole
SMILESCCc1cc(CC)n(C2=NCCN2)n1
InChIInChI=1S/C10H16N4/c1-3-8-7-9(4-2)14(13-8)10-11-5-6-12-10/h7H,3-6H2,1-2H3,(H,11,12)
InChIKeyLTXGXBWHFPPXEG-UHFFFAOYSA-N
XLogP0.82
TPSA42.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4,5-dihydro-1H-imidazol-2-yl)-3,5-diethylpyrazole?
The IUPAC name of 1-(4,5-dihydro-1H-imidazol-2-yl)-3,5-diethylpyrazole (CID 3332278) is 1-(4,5-dihydro-1H-imidazol-2-yl)-3,5-diethylpyrazole.
What is the SMILES notation for 1-(4,5-dihydro-1H-imidazol-2-yl)-3,5-diethylpyrazole?
The canonical SMILES for 1-(4,5-dihydro-1H-imidazol-2-yl)-3,5-diethylpyrazole is CCc1cc(CC)n(C2=NCCN2)n1.
What is the InChIKey of 1-(4,5-dihydro-1H-imidazol-2-yl)-3,5-diethylpyrazole?
The InChIKey is LTXGXBWHFPPXEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c1-3-8-7-9(4-2)14(13-8)10-11-5-6-12-10/h7H,3-6H2,1-2H3,(H,11,12).
What are the key properties of 1-(4,5-dihydro-1H-imidazol-2-yl)-3,5-diethylpyrazole?
1-(4,5-dihydro-1H-imidazol-2-yl)-3,5-diethylpyrazole has a molecular weight of 192.27 g/mol, XLogP of 0.82, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5-dihydro-1H-imidazol-2-yl)-3,5-diethylpyrazole is sourced from PubChem (CID 3332278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).