2-ethenyl-1-propyl-4,5-dihydroimidazole

C8H14N2 — CID 89037499

IUPAC2-ethenyl-1-propyl-4,5-dihydroimidazole
SMILESC=CC1=NCCN1CCC
InChIInChI=1S/C8H14N2/c1-3-6-10-7-5-9-8(10)4-2/h4H,2-3,5-7H2,1H3
InChIKeyWYDYIBXIIXDKNR-UHFFFAOYSA-N
MW138.21 g/mol
LogP1.30
Rot. Bonds3

About 2-ethenyl-1-propyl-4,5-dihydroimidazole

2-ethenyl-1-propyl-4,5-dihydroimidazole (PubChem CID 89037499) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 2-ethenyl-1-propyl-4,5-dihydroimidazole.

Molecular Properties

Compound Name2-ethenyl-1-propyl-4,5-dihydroimidazole
PubChem CID89037499
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name2-ethenyl-1-propyl-4,5-dihydroimidazole
SMILESC=CC1=NCCN1CCC
InChIInChI=1S/C8H14N2/c1-3-6-10-7-5-9-8(10)4-2/h4H,2-3,5-7H2,1H3
InChIKeyWYDYIBXIIXDKNR-UHFFFAOYSA-N
XLogP1.30
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-1-propyl-4,5-dihydroimidazole?
The IUPAC name of 2-ethenyl-1-propyl-4,5-dihydroimidazole (CID 89037499) is 2-ethenyl-1-propyl-4,5-dihydroimidazole.
What is the SMILES notation for 2-ethenyl-1-propyl-4,5-dihydroimidazole?
The canonical SMILES for 2-ethenyl-1-propyl-4,5-dihydroimidazole is C=CC1=NCCN1CCC.
What is the InChIKey of 2-ethenyl-1-propyl-4,5-dihydroimidazole?
The InChIKey is WYDYIBXIIXDKNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c1-3-6-10-7-5-9-8(10)4-2/h4H,2-3,5-7H2,1H3.
What are the key properties of 2-ethenyl-1-propyl-4,5-dihydroimidazole?
2-ethenyl-1-propyl-4,5-dihydroimidazole has a molecular weight of 138.21 g/mol, XLogP of 1.30, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-1-propyl-4,5-dihydroimidazole is sourced from PubChem (CID 89037499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).