2,4-dimethyl-1-propan-2-ylimidazole

C8H14N2 — CID 22891709

IUPAC2,4-dimethyl-1-propan-2-ylimidazole
SMILESCc1cn(C(C)C)c(C)n1
InChIInChI=1S/C8H14N2/c1-6(2)10-5-7(3)9-8(10)4/h5-6H,1-4H3
InChIKeyCHBYNWPTIUNQDI-UHFFFAOYSA-N
MW138.21 g/mol
LogP2.08
Rot. Bonds1

About 2,4-dimethyl-1-propan-2-ylimidazole

2,4-dimethyl-1-propan-2-ylimidazole (PubChem CID 22891709) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 2,4-dimethyl-1-propan-2-ylimidazole.

Molecular Properties

Compound Name2,4-dimethyl-1-propan-2-ylimidazole
PubChem CID22891709
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name2,4-dimethyl-1-propan-2-ylimidazole
SMILESCc1cn(C(C)C)c(C)n1
InChIInChI=1S/C8H14N2/c1-6(2)10-5-7(3)9-8(10)4/h5-6H,1-4H3
InChIKeyCHBYNWPTIUNQDI-UHFFFAOYSA-N
XLogP2.08
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Ethyl-4-methylimidazole
CID 70262
2,4-Dimethylimidazole
CID 70259
1,5-Dimethylimidazole
CID 139158
1,4-Dimethylimidazole
CID 138733
1H-Imidazole-1-propanenitrile, 2-ethyl-4-methyl-
CID 90327
N-methyl-N-[4-(5-methylimidazol-1-yl)but-2-ynyl]acetamide
CID 15065558
N-methyl-N-[5-(5-methylimidazol-1-yl)pent-3-yn-2-yl]acetamide
CID 15065560
1,1,3-Trimethyl-3-[4-(5-methylimidazol-1-yl)but-2-ynyl]urea
CID 15065574
1,3-Dihydro-1-methyl-3-[4-(5-methyl-1H-imidazol-1-yl)-2-butynyl]-2H-imidazol-2-one
CID 15065580
2-(1-Isopropyl-1H-imidazol-4-yl)ethanamine
CID 585835
1,5-Dimethyl-2-nitro-1H-imidazole
CID 78888
Imidazole, 1,4-dimethyl-2-nitro-
CID 79181

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-1-propan-2-ylimidazole?
The IUPAC name of 2,4-dimethyl-1-propan-2-ylimidazole (CID 22891709) is 2,4-dimethyl-1-propan-2-ylimidazole.
What is the SMILES notation for 2,4-dimethyl-1-propan-2-ylimidazole?
The canonical SMILES for 2,4-dimethyl-1-propan-2-ylimidazole is Cc1cn(C(C)C)c(C)n1.
What is the InChIKey of 2,4-dimethyl-1-propan-2-ylimidazole?
The InChIKey is CHBYNWPTIUNQDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c1-6(2)10-5-7(3)9-8(10)4/h5-6H,1-4H3.
What are the key properties of 2,4-dimethyl-1-propan-2-ylimidazole?
2,4-dimethyl-1-propan-2-ylimidazole has a molecular weight of 138.21 g/mol, XLogP of 2.08, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-1-propan-2-ylimidazole is sourced from PubChem (CID 22891709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).