(4E)-5-methylidene-4-propylidene-1H-imidazole

C7H10N2 — CID 167102052

IUPAC(4E)-5-methylidene-4-propylidene-1H-imidazole
SMILESC=c1[nH]cn/c1=C/CC
InChIInChI=1S/C7H10N2/c1-3-4-7-6(2)8-5-9-7/h4-5H,2-3H2,1H3,(H,8,9)/b7-4+
InChIKeyCEYTZKFOSJIAEU-QPJJXVBHSA-N
MW122.17 g/mol
LogP0.01
Rot. Bonds1

About (4E)-5-methylidene-4-propylidene-1H-imidazole

(4E)-5-methylidene-4-propylidene-1H-imidazole (PubChem CID 167102052) has the molecular formula C7H10N2 and a molecular weight of 122.17 g/mol. Its IUPAC name is (4E)-5-methylidene-4-propylidene-1H-imidazole.

Molecular Properties

Compound Name(4E)-5-methylidene-4-propylidene-1H-imidazole
PubChem CID167102052
Molecular FormulaC7H10N2
Molecular Weight122.17 g/mol
Exact Mass122.08
IUPAC Name(4E)-5-methylidene-4-propylidene-1H-imidazole
SMILESC=c1[nH]cn/c1=C/CC
InChIInChI=1S/C7H10N2/c1-3-4-7-6(2)8-5-9-7/h4-5H,2-3H2,1H3,(H,8,9)/b7-4+
InChIKeyCEYTZKFOSJIAEU-QPJJXVBHSA-N
XLogP0.01
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.17
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4E)-5-methylidene-4-propylidene-1H-imidazole?
The IUPAC name of (4E)-5-methylidene-4-propylidene-1H-imidazole (CID 167102052) is (4E)-5-methylidene-4-propylidene-1H-imidazole.
What is the SMILES notation for (4E)-5-methylidene-4-propylidene-1H-imidazole?
The canonical SMILES for (4E)-5-methylidene-4-propylidene-1H-imidazole is C=c1[nH]cn/c1=C/CC.
What is the InChIKey of (4E)-5-methylidene-4-propylidene-1H-imidazole?
The InChIKey is CEYTZKFOSJIAEU-QPJJXVBHSA-N. The full InChI is InChI=1S/C7H10N2/c1-3-4-7-6(2)8-5-9-7/h4-5H,2-3H2,1H3,(H,8,9)/b7-4+.
What are the key properties of (4E)-5-methylidene-4-propylidene-1H-imidazole?
(4E)-5-methylidene-4-propylidene-1H-imidazole has a molecular weight of 122.17 g/mol, XLogP of 0.01, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4E)-5-methylidene-4-propylidene-1H-imidazole is sourced from PubChem (CID 167102052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).