2-methyl-1-pent-1-en-2-yl-4,5-dihydroimidazole

C9H16N2 — CID 122608806

IUPAC2-methyl-1-pent-1-en-2-yl-4,5-dihydroimidazole
SMILESC=C(CCC)N1CCN=C1C
InChIInChI=1S/C9H16N2/c1-4-5-8(2)11-7-6-10-9(11)3/h2,4-7H2,1,3H3
InChIKeyOHZQDDFGOFGIHN-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.03
Rot. Bonds3

About 2-methyl-1-pent-1-en-2-yl-4,5-dihydroimidazole

2-methyl-1-pent-1-en-2-yl-4,5-dihydroimidazole (PubChem CID 122608806) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is 2-methyl-1-pent-1-en-2-yl-4,5-dihydroimidazole.

Molecular Properties

Compound Name2-methyl-1-pent-1-en-2-yl-4,5-dihydroimidazole
PubChem CID122608806
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name2-methyl-1-pent-1-en-2-yl-4,5-dihydroimidazole
SMILESC=C(CCC)N1CCN=C1C
InChIInChI=1S/C9H16N2/c1-4-5-8(2)11-7-6-10-9(11)3/h2,4-7H2,1,3H3
InChIKeyOHZQDDFGOFGIHN-UHFFFAOYSA-N
XLogP2.03
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-pent-1-en-2-yl-4,5-dihydroimidazole?
The IUPAC name of 2-methyl-1-pent-1-en-2-yl-4,5-dihydroimidazole (CID 122608806) is 2-methyl-1-pent-1-en-2-yl-4,5-dihydroimidazole.
What is the SMILES notation for 2-methyl-1-pent-1-en-2-yl-4,5-dihydroimidazole?
The canonical SMILES for 2-methyl-1-pent-1-en-2-yl-4,5-dihydroimidazole is C=C(CCC)N1CCN=C1C.
What is the InChIKey of 2-methyl-1-pent-1-en-2-yl-4,5-dihydroimidazole?
The InChIKey is OHZQDDFGOFGIHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2/c1-4-5-8(2)11-7-6-10-9(11)3/h2,4-7H2,1,3H3.
What are the key properties of 2-methyl-1-pent-1-en-2-yl-4,5-dihydroimidazole?
2-methyl-1-pent-1-en-2-yl-4,5-dihydroimidazole has a molecular weight of 152.24 g/mol, XLogP of 2.03, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-pent-1-en-2-yl-4,5-dihydroimidazole is sourced from PubChem (CID 122608806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).