1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]-2-ethenyl-4,5-dihydroimidazole

C10H16N4 — CID 169054232

IUPAC1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]-2-ethenyl-4,5-dihydroimidazole
SMILESC=CC1=NCCN1CCC1=NCCN1
InChIInChI=1S/C10H16N4/c1-2-10-13-6-8-14(10)7-3-9-11-4-5-12-9/h2H,1,3-8H2,(H,11,12)
InChIKeyAMGIIGWJLOHDHF-UHFFFAOYSA-N
MW192.27 g/mol
LogP0.28
Rot. Bonds4

About 1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]-2-ethenyl-4,5-dihydroimidazole

1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]-2-ethenyl-4,5-dihydroimidazole (PubChem CID 169054232) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is 1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]-2-ethenyl-4,5-dihydroimidazole.

Molecular Properties

Compound Name1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]-2-ethenyl-4,5-dihydroimidazole
PubChem CID169054232
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]-2-ethenyl-4,5-dihydroimidazole
SMILESC=CC1=NCCN1CCC1=NCCN1
InChIInChI=1S/C10H16N4/c1-2-10-13-6-8-14(10)7-3-9-11-4-5-12-9/h2H,1,3-8H2,(H,11,12)
InChIKeyAMGIIGWJLOHDHF-UHFFFAOYSA-N
XLogP0.28
TPSA39.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]-2-ethenyl-4,5-dihydroimidazole?
The IUPAC name of 1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]-2-ethenyl-4,5-dihydroimidazole (CID 169054232) is 1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]-2-ethenyl-4,5-dihydroimidazole.
What is the SMILES notation for 1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]-2-ethenyl-4,5-dihydroimidazole?
The canonical SMILES for 1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]-2-ethenyl-4,5-dihydroimidazole is C=CC1=NCCN1CCC1=NCCN1.
What is the InChIKey of 1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]-2-ethenyl-4,5-dihydroimidazole?
The InChIKey is AMGIIGWJLOHDHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c1-2-10-13-6-8-14(10)7-3-9-11-4-5-12-9/h2H,1,3-8H2,(H,11,12).
What are the key properties of 1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]-2-ethenyl-4,5-dihydroimidazole?
1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]-2-ethenyl-4,5-dihydroimidazole has a molecular weight of 192.27 g/mol, XLogP of 0.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]-2-ethenyl-4,5-dihydroimidazole is sourced from PubChem (CID 169054232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).