5,7,7-trimethyl-2,3-dihydropyrrolo[1,2-a]imidazole

C9H14N2 — CID 154090366

IUPAC5,7,7-trimethyl-2,3-dihydropyrrolo[1,2-a]imidazole
SMILESCC1=CC(C)(C)C2=NCCN12
InChIInChI=1S/C9H14N2/c1-7-6-9(2,3)8-10-4-5-11(7)8/h6H,4-5H2,1-3H3
InChIKeyJEXBPZCILGPQGY-UHFFFAOYSA-N
MW150.22 g/mol
LogP1.64
Rot. Bonds

About 5,7,7-trimethyl-2,3-dihydropyrrolo[1,2-a]imidazole

5,7,7-trimethyl-2,3-dihydropyrrolo[1,2-a]imidazole (PubChem CID 154090366) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 5,7,7-trimethyl-2,3-dihydropyrrolo[1,2-a]imidazole.

Molecular Properties

Compound Name5,7,7-trimethyl-2,3-dihydropyrrolo[1,2-a]imidazole
PubChem CID154090366
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name5,7,7-trimethyl-2,3-dihydropyrrolo[1,2-a]imidazole
SMILESCC1=CC(C)(C)C2=NCCN12
InChIInChI=1S/C9H14N2/c1-7-6-9(2,3)8-10-4-5-11(7)8/h6H,4-5H2,1-3H3
InChIKeyJEXBPZCILGPQGY-UHFFFAOYSA-N
XLogP1.64
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-Methyl-2-[(1-methyl-2,3-dihydropyrrol-5-yl)methyl]-4,5-dihydroimidazole
CID 20692436
1-[2-(1,5-Dimethyl-2,3-dihydropyrrol-1-ium-1-yl)ethyl]-1,2-dimethyl-4,5-dihydroimidazol-1-ium
CID 59960083
N,1-dibutyl-3,3,5-trimethylpyrrol-2-imine
CID 154091731
6,8,8-trimethyl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidine
CID 154164313
(E)-1-(1,3-dimethyl-4,5-dihydroimidazol-1-ium-2-yl)-N,N,3,3-tetramethylbut-1-en-2-amine
CID 134873524

Frequently Asked Questions

What is the IUPAC name of 5,7,7-trimethyl-2,3-dihydropyrrolo[1,2-a]imidazole?
The IUPAC name of 5,7,7-trimethyl-2,3-dihydropyrrolo[1,2-a]imidazole (CID 154090366) is 5,7,7-trimethyl-2,3-dihydropyrrolo[1,2-a]imidazole.
What is the SMILES notation for 5,7,7-trimethyl-2,3-dihydropyrrolo[1,2-a]imidazole?
The canonical SMILES for 5,7,7-trimethyl-2,3-dihydropyrrolo[1,2-a]imidazole is CC1=CC(C)(C)C2=NCCN12.
What is the InChIKey of 5,7,7-trimethyl-2,3-dihydropyrrolo[1,2-a]imidazole?
The InChIKey is JEXBPZCILGPQGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-7-6-9(2,3)8-10-4-5-11(7)8/h6H,4-5H2,1-3H3.
What are the key properties of 5,7,7-trimethyl-2,3-dihydropyrrolo[1,2-a]imidazole?
5,7,7-trimethyl-2,3-dihydropyrrolo[1,2-a]imidazole has a molecular weight of 150.22 g/mol, XLogP of 1.64, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7,7-trimethyl-2,3-dihydropyrrolo[1,2-a]imidazole is sourced from PubChem (CID 154090366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).