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

C7H10N4 — CID 82240877

IUPAC4-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazole
SMILESCn1cc(C2=NCCN2)cn1
InChIInChI=1S/C7H10N4/c1-11-5-6(4-10-11)7-8-2-3-9-7/h4-5H,2-3H2,1H3,(H,8,9)
InChIKeyGZLPYQOLYYMAIF-UHFFFAOYSA-N
MW150.19 g/mol
LogP-0.23
Rot. Bonds1

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

4-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazole (PubChem CID 82240877) has the molecular formula C7H10N4 and a molecular weight of 150.19 g/mol. Its IUPAC name is 4-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazole.

Molecular Properties

Compound Name4-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazole
PubChem CID82240877
Molecular FormulaC7H10N4
Molecular Weight150.19 g/mol
Exact Mass150.09
IUPAC Name4-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazole
SMILESCn1cc(C2=NCCN2)cn1
InChIInChI=1S/C7H10N4/c1-11-5-6(4-10-11)7-8-2-3-9-7/h4-5H,2-3H2,1H3,(H,8,9)
InChIKeyGZLPYQOLYYMAIF-UHFFFAOYSA-N
XLogP-0.23
TPSA42.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.19
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazole?
The IUPAC name of 4-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazole (CID 82240877) is 4-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazole.
What is the SMILES notation for 4-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazole?
The canonical SMILES for 4-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazole is Cn1cc(C2=NCCN2)cn1.
What is the InChIKey of 4-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazole?
The InChIKey is GZLPYQOLYYMAIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4/c1-11-5-6(4-10-11)7-8-2-3-9-7/h4-5H,2-3H2,1H3,(H,8,9).
What are the key properties of 4-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazole?
4-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazole has a molecular weight of 150.19 g/mol, XLogP of -0.23, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazole is sourced from PubChem (CID 82240877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).