2,5-dihydro-1H-imidazole

C3H6N2 — CID 19845229

IUPAC2,5-dihydro-1H-imidazole
SMILESC1=NCNC1
InChIInChI=1S/C3H6N2/c1-2-5-3-4-1/h1,5H,2-3H2
InChIKeyFFMBYMANYCDCMK-UHFFFAOYSA-N
MW70.09 g/mol
LogP-0.38
Rot. Bonds

About 2,5-dihydro-1H-imidazole

2,5-dihydro-1H-imidazole (PubChem CID 19845229) has the molecular formula C3H6N2 and a molecular weight of 70.09 g/mol. Its IUPAC name is 2,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2,5-dihydro-1H-imidazole
PubChem CID19845229
Molecular FormulaC3H6N2
Molecular Weight70.09 g/mol
Exact Mass70.05
IUPAC Name2,5-dihydro-1H-imidazole
SMILESC1=NCNC1
InChIInChI=1S/C3H6N2/c1-2-5-3-4-1/h1,5H,2-3H2
InChIKeyFFMBYMANYCDCMK-UHFFFAOYSA-N
XLogP-0.38
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50070.09
LogP ≤ 5-0.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,5-dihydro-1H-imidazole?
The IUPAC name of 2,5-dihydro-1H-imidazole (CID 19845229) is 2,5-dihydro-1H-imidazole.
What is the SMILES notation for 2,5-dihydro-1H-imidazole?
The canonical SMILES for 2,5-dihydro-1H-imidazole is C1=NCNC1.
What is the InChIKey of 2,5-dihydro-1H-imidazole?
The InChIKey is FFMBYMANYCDCMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6N2/c1-2-5-3-4-1/h1,5H,2-3H2.
What are the key properties of 2,5-dihydro-1H-imidazole?
2,5-dihydro-1H-imidazole has a molecular weight of 70.09 g/mol, XLogP of -0.38, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dihydro-1H-imidazole is sourced from PubChem (CID 19845229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).