1-methyl-2-[2-(1-methylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)propyl]imidazole

C15H20N6 — CID 118209430

IUPAC1-methyl-2-[2-(1-methylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)propyl]imidazole
SMILESCn1cc(CC(Cc2nccn2C)c2ccn(C)n2)cn1
InChIInChI=1S/C15H20N6/c1-19-7-5-16-15(19)9-13(14-4-6-20(2)18-14)8-12-10-17-21(3)11-12/h4-7,10-11,13H,8-9H2,1-3H3
InChIKeyIUTDMBMNXAPJJK-UHFFFAOYSA-N
MW284.37 g/mol
LogP1.46
Rot. Bonds5

About 1-methyl-2-[2-(1-methylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)propyl]imidazole

1-methyl-2-[2-(1-methylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)propyl]imidazole (PubChem CID 118209430) has the molecular formula C15H20N6 and a molecular weight of 284.37 g/mol. Its IUPAC name is 1-methyl-2-[2-(1-methylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)propyl]imidazole.

Molecular Properties

Compound Name1-methyl-2-[2-(1-methylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)propyl]imidazole
PubChem CID118209430
Molecular FormulaC15H20N6
Molecular Weight284.37 g/mol
Exact Mass284.17
IUPAC Name1-methyl-2-[2-(1-methylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)propyl]imidazole
SMILESCn1cc(CC(Cc2nccn2C)c2ccn(C)n2)cn1
InChIInChI=1S/C15H20N6/c1-19-7-5-16-15(19)9-13(14-4-6-20(2)18-14)8-12-10-17-21(3)11-12/h4-7,10-11,13H,8-9H2,1-3H3
InChIKeyIUTDMBMNXAPJJK-UHFFFAOYSA-N
XLogP1.46
TPSA53.46 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.37
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[2-(1-methylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)propyl]imidazole?
The IUPAC name of 1-methyl-2-[2-(1-methylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)propyl]imidazole (CID 118209430) is 1-methyl-2-[2-(1-methylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)propyl]imidazole.
What is the SMILES notation for 1-methyl-2-[2-(1-methylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)propyl]imidazole?
The canonical SMILES for 1-methyl-2-[2-(1-methylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)propyl]imidazole is Cn1cc(CC(Cc2nccn2C)c2ccn(C)n2)cn1.
What is the InChIKey of 1-methyl-2-[2-(1-methylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)propyl]imidazole?
The InChIKey is IUTDMBMNXAPJJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6/c1-19-7-5-16-15(19)9-13(14-4-6-20(2)18-14)8-12-10-17-21(3)11-12/h4-7,10-11,13H,8-9H2,1-3H3.
What are the key properties of 1-methyl-2-[2-(1-methylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)propyl]imidazole?
1-methyl-2-[2-(1-methylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)propyl]imidazole has a molecular weight of 284.37 g/mol, XLogP of 1.46, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[2-(1-methylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)propyl]imidazole is sourced from PubChem (CID 118209430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).