2,3,4-trimethyl-1-propan-2-yl-2H-imidazole

C9H18N2 — CID 23077214

IUPAC2,3,4-trimethyl-1-propan-2-yl-2H-imidazole
SMILESCC1=CN(C(C)C)C(C)N1C
InChIInChI=1S/C9H18N2/c1-7(2)11-6-8(3)10(5)9(11)4/h6-7,9H,1-5H3
InChIKeyCWGUYLJHCHGPCK-UHFFFAOYSA-N
MW154.26 g/mol
LogP1.85
Rot. Bonds1

About 2,3,4-trimethyl-1-propan-2-yl-2H-imidazole

2,3,4-trimethyl-1-propan-2-yl-2H-imidazole (PubChem CID 23077214) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 2,3,4-trimethyl-1-propan-2-yl-2H-imidazole.

Molecular Properties

Compound Name2,3,4-trimethyl-1-propan-2-yl-2H-imidazole
PubChem CID23077214
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name2,3,4-trimethyl-1-propan-2-yl-2H-imidazole
SMILESCC1=CN(C(C)C)C(C)N1C
InChIInChI=1S/C9H18N2/c1-7(2)11-6-8(3)10(5)9(11)4/h6-7,9H,1-5H3
InChIKeyCWGUYLJHCHGPCK-UHFFFAOYSA-N
XLogP1.85
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3,4-trimethyl-1-propan-2-yl-2H-imidazole?
The IUPAC name of 2,3,4-trimethyl-1-propan-2-yl-2H-imidazole (CID 23077214) is 2,3,4-trimethyl-1-propan-2-yl-2H-imidazole.
What is the SMILES notation for 2,3,4-trimethyl-1-propan-2-yl-2H-imidazole?
The canonical SMILES for 2,3,4-trimethyl-1-propan-2-yl-2H-imidazole is CC1=CN(C(C)C)C(C)N1C.
What is the InChIKey of 2,3,4-trimethyl-1-propan-2-yl-2H-imidazole?
The InChIKey is CWGUYLJHCHGPCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-7(2)11-6-8(3)10(5)9(11)4/h6-7,9H,1-5H3.
What are the key properties of 2,3,4-trimethyl-1-propan-2-yl-2H-imidazole?
2,3,4-trimethyl-1-propan-2-yl-2H-imidazole has a molecular weight of 154.26 g/mol, XLogP of 1.85, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4-trimethyl-1-propan-2-yl-2H-imidazole is sourced from PubChem (CID 23077214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).