3-methyl-4,5-di(propan-2-yl)-1,2-dihydroimidazole

C10H20N2 — CID 130432035

IUPAC3-methyl-4,5-di(propan-2-yl)-1,2-dihydroimidazole
SMILESCC(C)C1=C(C(C)C)N(C)CN1
InChIInChI=1S/C10H20N2/c1-7(2)9-10(8(3)4)12(5)6-11-9/h7-8,11H,6H2,1-5H3
InChIKeyLUGYJLBIMANNSK-UHFFFAOYSA-N
MW168.28 g/mol
LogP2.00
Rot. Bonds2

About 3-methyl-4,5-di(propan-2-yl)-1,2-dihydroimidazole

3-methyl-4,5-di(propan-2-yl)-1,2-dihydroimidazole (PubChem CID 130432035) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 3-methyl-4,5-di(propan-2-yl)-1,2-dihydroimidazole.

Molecular Properties

Compound Name3-methyl-4,5-di(propan-2-yl)-1,2-dihydroimidazole
PubChem CID130432035
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name3-methyl-4,5-di(propan-2-yl)-1,2-dihydroimidazole
SMILESCC(C)C1=C(C(C)C)N(C)CN1
InChIInChI=1S/C10H20N2/c1-7(2)9-10(8(3)4)12(5)6-11-9/h7-8,11H,6H2,1-5H3
InChIKeyLUGYJLBIMANNSK-UHFFFAOYSA-N
XLogP2.00
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-4,5-di(propan-2-yl)-1,2-dihydroimidazole?
The IUPAC name of 3-methyl-4,5-di(propan-2-yl)-1,2-dihydroimidazole (CID 130432035) is 3-methyl-4,5-di(propan-2-yl)-1,2-dihydroimidazole.
What is the SMILES notation for 3-methyl-4,5-di(propan-2-yl)-1,2-dihydroimidazole?
The canonical SMILES for 3-methyl-4,5-di(propan-2-yl)-1,2-dihydroimidazole is CC(C)C1=C(C(C)C)N(C)CN1.
What is the InChIKey of 3-methyl-4,5-di(propan-2-yl)-1,2-dihydroimidazole?
The InChIKey is LUGYJLBIMANNSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-7(2)9-10(8(3)4)12(5)6-11-9/h7-8,11H,6H2,1-5H3.
What are the key properties of 3-methyl-4,5-di(propan-2-yl)-1,2-dihydroimidazole?
3-methyl-4,5-di(propan-2-yl)-1,2-dihydroimidazole has a molecular weight of 168.28 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4,5-di(propan-2-yl)-1,2-dihydroimidazole is sourced from PubChem (CID 130432035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).