2,2,6,6-tetramethyl-3,5-dihydro-1H-imidazo[1,2-a]imidazole

C9H17N3 — CID 58312371

IUPAC2,2,6,6-tetramethyl-3,5-dihydro-1H-imidazo[1,2-a]imidazole
SMILESCC1(C)CN2CC(C)(C)NC2=N1
InChIInChI=1S/C9H17N3/c1-8(2)5-12-6-9(3,4)11-7(12)10-8/h5-6H2,1-4H3,(H,10,11)
InChIKeyIXCQQCDIFRLSHV-UHFFFAOYSA-N
MW167.26 g/mol
LogP0.82
Rot. Bonds

About 2,2,6,6-tetramethyl-3,5-dihydro-1H-imidazo[1,2-a]imidazole

2,2,6,6-tetramethyl-3,5-dihydro-1H-imidazo[1,2-a]imidazole (PubChem CID 58312371) has the molecular formula C9H17N3 and a molecular weight of 167.26 g/mol. Its IUPAC name is 2,2,6,6-tetramethyl-3,5-dihydro-1H-imidazo[1,2-a]imidazole.

Molecular Properties

Compound Name2,2,6,6-tetramethyl-3,5-dihydro-1H-imidazo[1,2-a]imidazole
PubChem CID58312371
Molecular FormulaC9H17N3
Molecular Weight167.26 g/mol
Exact Mass167.14
IUPAC Name2,2,6,6-tetramethyl-3,5-dihydro-1H-imidazo[1,2-a]imidazole
SMILESCC1(C)CN2CC(C)(C)NC2=N1
InChIInChI=1S/C9H17N3/c1-8(2)5-12-6-9(3,4)11-7(12)10-8/h5-6H2,1-4H3,(H,10,11)
InChIKeyIXCQQCDIFRLSHV-UHFFFAOYSA-N
XLogP0.82
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.26
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2,6,6-tetramethyl-3,5-dihydro-1H-imidazo[1,2-a]imidazole?
The IUPAC name of 2,2,6,6-tetramethyl-3,5-dihydro-1H-imidazo[1,2-a]imidazole (CID 58312371) is 2,2,6,6-tetramethyl-3,5-dihydro-1H-imidazo[1,2-a]imidazole.
What is the SMILES notation for 2,2,6,6-tetramethyl-3,5-dihydro-1H-imidazo[1,2-a]imidazole?
The canonical SMILES for 2,2,6,6-tetramethyl-3,5-dihydro-1H-imidazo[1,2-a]imidazole is CC1(C)CN2CC(C)(C)NC2=N1.
What is the InChIKey of 2,2,6,6-tetramethyl-3,5-dihydro-1H-imidazo[1,2-a]imidazole?
The InChIKey is IXCQQCDIFRLSHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3/c1-8(2)5-12-6-9(3,4)11-7(12)10-8/h5-6H2,1-4H3,(H,10,11).
What are the key properties of 2,2,6,6-tetramethyl-3,5-dihydro-1H-imidazo[1,2-a]imidazole?
2,2,6,6-tetramethyl-3,5-dihydro-1H-imidazo[1,2-a]imidazole has a molecular weight of 167.26 g/mol, XLogP of 0.82, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,6,6-tetramethyl-3,5-dihydro-1H-imidazo[1,2-a]imidazole is sourced from PubChem (CID 58312371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).