6,6-dimethyl-2,3-dihydro-1H-cyclohepta[d]imidazole

C10H14N2 — CID 144801663

IUPAC6,6-dimethyl-2,3-dihydro-1H-cyclohepta[d]imidazole
SMILESCC1(C)C=CC2=C(C=C1)NCN2
InChIInChI=1S/C10H14N2/c1-10(2)5-3-8-9(4-6-10)12-7-11-8/h3-6,11-12H,7H2,1-2H3
InChIKeyOHIXZNKIKZRGFD-UHFFFAOYSA-N
MW162.24 g/mol
LogP1.50
Rot. Bonds

About 6,6-dimethyl-2,3-dihydro-1H-cyclohepta[d]imidazole

6,6-dimethyl-2,3-dihydro-1H-cyclohepta[d]imidazole (PubChem CID 144801663) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is 6,6-dimethyl-2,3-dihydro-1H-cyclohepta[d]imidazole.

Molecular Properties

Compound Name6,6-dimethyl-2,3-dihydro-1H-cyclohepta[d]imidazole
PubChem CID144801663
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name6,6-dimethyl-2,3-dihydro-1H-cyclohepta[d]imidazole
SMILESCC1(C)C=CC2=C(C=C1)NCN2
InChIInChI=1S/C10H14N2/c1-10(2)5-3-8-9(4-6-10)12-7-11-8/h3-6,11-12H,7H2,1-2H3
InChIKeyOHIXZNKIKZRGFD-UHFFFAOYSA-N
XLogP1.50
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6,6-dimethyl-2,3-dihydro-1H-cyclohepta[d]imidazole?
The IUPAC name of 6,6-dimethyl-2,3-dihydro-1H-cyclohepta[d]imidazole (CID 144801663) is 6,6-dimethyl-2,3-dihydro-1H-cyclohepta[d]imidazole.
What is the SMILES notation for 6,6-dimethyl-2,3-dihydro-1H-cyclohepta[d]imidazole?
The canonical SMILES for 6,6-dimethyl-2,3-dihydro-1H-cyclohepta[d]imidazole is CC1(C)C=CC2=C(C=C1)NCN2.
What is the InChIKey of 6,6-dimethyl-2,3-dihydro-1H-cyclohepta[d]imidazole?
The InChIKey is OHIXZNKIKZRGFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c1-10(2)5-3-8-9(4-6-10)12-7-11-8/h3-6,11-12H,7H2,1-2H3.
What are the key properties of 6,6-dimethyl-2,3-dihydro-1H-cyclohepta[d]imidazole?
6,6-dimethyl-2,3-dihydro-1H-cyclohepta[d]imidazole has a molecular weight of 162.24 g/mol, XLogP of 1.50, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-dimethyl-2,3-dihydro-1H-cyclohepta[d]imidazole is sourced from PubChem (CID 144801663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).