4-methyl-5-[(Z)-prop-1-enyl]imidazole

C7H8N2 — CID 130368436

IUPAC4-methyl-5-[(Z)-prop-1-enyl]imidazole
SMILESC/C=C\C1=C(C)N=C=N1
InChIInChI=1S/C7H8N2/c1-3-4-7-6(2)8-5-9-7/h3-4H,1-2H3/b4-3-
InChIKeyUVMFURZXNCMQJQ-ARJAWSKDSA-N
MW120.15 g/mol
LogP1.98
Rot. Bonds1

About 4-methyl-5-[(Z)-prop-1-enyl]imidazole

4-methyl-5-[(Z)-prop-1-enyl]imidazole (PubChem CID 130368436) has the molecular formula C7H8N2 and a molecular weight of 120.15 g/mol. Its IUPAC name is 4-methyl-5-[(Z)-prop-1-enyl]imidazole.

Molecular Properties

Compound Name4-methyl-5-[(Z)-prop-1-enyl]imidazole
PubChem CID130368436
Molecular FormulaC7H8N2
Molecular Weight120.15 g/mol
Exact Mass120.07
IUPAC Name4-methyl-5-[(Z)-prop-1-enyl]imidazole
SMILESC/C=C\C1=C(C)N=C=N1
InChIInChI=1S/C7H8N2/c1-3-4-7-6(2)8-5-9-7/h3-4H,1-2H3/b4-3-
InChIKeyUVMFURZXNCMQJQ-ARJAWSKDSA-N
XLogP1.98
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.15
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-[(Z)-prop-1-enyl]imidazole?
The IUPAC name of 4-methyl-5-[(Z)-prop-1-enyl]imidazole (CID 130368436) is 4-methyl-5-[(Z)-prop-1-enyl]imidazole.
What is the SMILES notation for 4-methyl-5-[(Z)-prop-1-enyl]imidazole?
The canonical SMILES for 4-methyl-5-[(Z)-prop-1-enyl]imidazole is C/C=C\C1=C(C)N=C=N1.
What is the InChIKey of 4-methyl-5-[(Z)-prop-1-enyl]imidazole?
The InChIKey is UVMFURZXNCMQJQ-ARJAWSKDSA-N. The full InChI is InChI=1S/C7H8N2/c1-3-4-7-6(2)8-5-9-7/h3-4H,1-2H3/b4-3-.
What are the key properties of 4-methyl-5-[(Z)-prop-1-enyl]imidazole?
4-methyl-5-[(Z)-prop-1-enyl]imidazole has a molecular weight of 120.15 g/mol, XLogP of 1.98, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-[(Z)-prop-1-enyl]imidazole is sourced from PubChem (CID 130368436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).