1-(2-methylpropyl)-2-propylimidazole

C10H18N2 — CID 15557011

IUPAC1-(2-methylpropyl)-2-propylimidazole
SMILESCCCc1nccn1CC(C)C
InChIInChI=1S/C10H18N2/c1-4-5-10-11-6-7-12(10)8-9(2)3/h6-7,9H,4-5,8H2,1-3H3
InChIKeyYMNQJNXOBGXEAI-UHFFFAOYSA-N
MW166.27 g/mol
LogP2.49
Rot. Bonds4

About 1-(2-methylpropyl)-2-propylimidazole

1-(2-methylpropyl)-2-propylimidazole (PubChem CID 15557011) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 1-(2-methylpropyl)-2-propylimidazole.

Molecular Properties

Compound Name1-(2-methylpropyl)-2-propylimidazole
PubChem CID15557011
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name1-(2-methylpropyl)-2-propylimidazole
SMILESCCCc1nccn1CC(C)C
InChIInChI=1S/C10H18N2/c1-4-5-10-11-6-7-12(10)8-9(2)3/h6-7,9H,4-5,8H2,1-3H3
InChIKeyYMNQJNXOBGXEAI-UHFFFAOYSA-N
XLogP2.49
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpropyl)-2-propylimidazole?
The IUPAC name of 1-(2-methylpropyl)-2-propylimidazole (CID 15557011) is 1-(2-methylpropyl)-2-propylimidazole.
What is the SMILES notation for 1-(2-methylpropyl)-2-propylimidazole?
The canonical SMILES for 1-(2-methylpropyl)-2-propylimidazole is CCCc1nccn1CC(C)C.
What is the InChIKey of 1-(2-methylpropyl)-2-propylimidazole?
The InChIKey is YMNQJNXOBGXEAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-4-5-10-11-6-7-12(10)8-9(2)3/h6-7,9H,4-5,8H2,1-3H3.
What are the key properties of 1-(2-methylpropyl)-2-propylimidazole?
1-(2-methylpropyl)-2-propylimidazole has a molecular weight of 166.27 g/mol, XLogP of 2.49, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpropyl)-2-propylimidazole is sourced from PubChem (CID 15557011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).