2-[(E)-prop-1-enyl]-4,5-dihydro-1H-imidazole

C6H10N2 — CID 15778570

IUPAC2-[(E)-prop-1-enyl]-4,5-dihydro-1H-imidazole
SMILESC/C=C/C1=NCCN1
InChIInChI=1S/C6H10N2/c1-2-3-6-7-4-5-8-6/h2-3H,4-5H2,1H3,(H,7,8)/b3-2+
InChIKeyFRPXCVVDHUMAFC-NSCUHMNNSA-N
MW110.16 g/mol
LogP0.56
Rot. Bonds1

About 2-[(E)-prop-1-enyl]-4,5-dihydro-1H-imidazole

2-[(E)-prop-1-enyl]-4,5-dihydro-1H-imidazole (PubChem CID 15778570) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is 2-[(E)-prop-1-enyl]-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-[(E)-prop-1-enyl]-4,5-dihydro-1H-imidazole
PubChem CID15778570
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC Name2-[(E)-prop-1-enyl]-4,5-dihydro-1H-imidazole
SMILESC/C=C/C1=NCCN1
InChIInChI=1S/C6H10N2/c1-2-3-6-7-4-5-8-6/h2-3H,4-5H2,1H3,(H,7,8)/b3-2+
InChIKeyFRPXCVVDHUMAFC-NSCUHMNNSA-N
XLogP0.56
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(E)-prop-1-enyl]-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-[(E)-prop-1-enyl]-4,5-dihydro-1H-imidazole (CID 15778570) is 2-[(E)-prop-1-enyl]-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-[(E)-prop-1-enyl]-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-[(E)-prop-1-enyl]-4,5-dihydro-1H-imidazole is C/C=C/C1=NCCN1.
What is the InChIKey of 2-[(E)-prop-1-enyl]-4,5-dihydro-1H-imidazole?
The InChIKey is FRPXCVVDHUMAFC-NSCUHMNNSA-N. The full InChI is InChI=1S/C6H10N2/c1-2-3-6-7-4-5-8-6/h2-3H,4-5H2,1H3,(H,7,8)/b3-2+.
What are the key properties of 2-[(E)-prop-1-enyl]-4,5-dihydro-1H-imidazole?
2-[(E)-prop-1-enyl]-4,5-dihydro-1H-imidazole has a molecular weight of 110.16 g/mol, XLogP of 0.56, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-prop-1-enyl]-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 15778570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).