benzene;2-cyclopropyl-4,5-dihydro-1H-imidazole

C12H16N2 — CID 145110900

IUPACbenzene;2-cyclopropyl-4,5-dihydro-1H-imidazole
SMILESC1CNC(C2CC2)=N1.c1ccccc1
InChIInChI=1S/C6H10N2.C6H6/c1-2-5(1)6-7-3-4-8-6;1-2-4-6-5-3-1/h5H,1-4H2,(H,7,8);1-6H
InChIKeyBRISEPVJTFMHCX-UHFFFAOYSA-N
MW188.27 g/mol
LogP2.08
Rot. Bonds1

About benzene;2-cyclopropyl-4,5-dihydro-1H-imidazole

benzene;2-cyclopropyl-4,5-dihydro-1H-imidazole (PubChem CID 145110900) has the molecular formula C12H16N2 and a molecular weight of 188.27 g/mol. Its IUPAC name is benzene;2-cyclopropyl-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Namebenzene;2-cyclopropyl-4,5-dihydro-1H-imidazole
PubChem CID145110900
Molecular FormulaC12H16N2
Molecular Weight188.27 g/mol
Exact Mass188.13
IUPAC Namebenzene;2-cyclopropyl-4,5-dihydro-1H-imidazole
SMILESC1CNC(C2CC2)=N1.c1ccccc1
InChIInChI=1S/C6H10N2.C6H6/c1-2-5(1)6-7-3-4-8-6;1-2-4-6-5-3-1/h5H,1-4H2,(H,7,8);1-6H
InChIKeyBRISEPVJTFMHCX-UHFFFAOYSA-N
XLogP2.08
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of benzene;2-cyclopropyl-4,5-dihydro-1H-imidazole?
The IUPAC name of benzene;2-cyclopropyl-4,5-dihydro-1H-imidazole (CID 145110900) is benzene;2-cyclopropyl-4,5-dihydro-1H-imidazole.
What is the SMILES notation for benzene;2-cyclopropyl-4,5-dihydro-1H-imidazole?
The canonical SMILES for benzene;2-cyclopropyl-4,5-dihydro-1H-imidazole is C1CNC(C2CC2)=N1.c1ccccc1.
What is the InChIKey of benzene;2-cyclopropyl-4,5-dihydro-1H-imidazole?
The InChIKey is BRISEPVJTFMHCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2.C6H6/c1-2-5(1)6-7-3-4-8-6;1-2-4-6-5-3-1/h5H,1-4H2,(H,7,8);1-6H.
What are the key properties of benzene;2-cyclopropyl-4,5-dihydro-1H-imidazole?
benzene;2-cyclopropyl-4,5-dihydro-1H-imidazole has a molecular weight of 188.27 g/mol, XLogP of 2.08, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;2-cyclopropyl-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 145110900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).