2,4-dimethyl-1-propylimidazole

C8H14N2 — CID 25232206

IUPAC2,4-dimethyl-1-propylimidazole
SMILESCCCn1cc(C)nc1C
InChIInChI=1S/C8H14N2/c1-4-5-10-6-7(2)9-8(10)3/h6H,4-5H2,1-3H3
InChIKeyHSTRVBYSLWZHSR-UHFFFAOYSA-N
MW138.21 g/mol
LogP1.91
Rot. Bonds2

About 2,4-dimethyl-1-propylimidazole

2,4-dimethyl-1-propylimidazole (PubChem CID 25232206) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 2,4-dimethyl-1-propylimidazole.

Molecular Properties

Compound Name2,4-dimethyl-1-propylimidazole
PubChem CID25232206
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name2,4-dimethyl-1-propylimidazole
SMILESCCCn1cc(C)nc1C
InChIInChI=1S/C8H14N2/c1-4-5-10-6-7(2)9-8(10)3/h6H,4-5H2,1-3H3
InChIKeyHSTRVBYSLWZHSR-UHFFFAOYSA-N
XLogP1.91
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-1-propylimidazole?
The IUPAC name of 2,4-dimethyl-1-propylimidazole (CID 25232206) is 2,4-dimethyl-1-propylimidazole.
What is the SMILES notation for 2,4-dimethyl-1-propylimidazole?
The canonical SMILES for 2,4-dimethyl-1-propylimidazole is CCCn1cc(C)nc1C.
What is the InChIKey of 2,4-dimethyl-1-propylimidazole?
The InChIKey is HSTRVBYSLWZHSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c1-4-5-10-6-7(2)9-8(10)3/h6H,4-5H2,1-3H3.
What are the key properties of 2,4-dimethyl-1-propylimidazole?
2,4-dimethyl-1-propylimidazole has a molecular weight of 138.21 g/mol, XLogP of 1.91, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-1-propylimidazole is sourced from PubChem (CID 25232206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).