methylidyne-[2-[(Z)-prop-1-enyl]imidazol-1-yl]azanium

C7H8N3+ — CID 170064715

IUPACmethylidyne-[2-[(Z)-prop-1-enyl]imidazol-1-yl]azanium
SMILESC#[N+]n1ccnc1/C=C\C
InChIInChI=1S/C7H8N3/c1-3-4-7-9-5-6-10(7)8-2/h2-6H,1H3/q+1/b4-3-
InChIKeyCWEWSLDTIUFIRO-ARJAWSKDSA-N
MW134.16 g/mol
LogP1.64
Rot. Bonds1

About methylidyne-[2-[(Z)-prop-1-enyl]imidazol-1-yl]azanium

methylidyne-[2-[(Z)-prop-1-enyl]imidazol-1-yl]azanium (PubChem CID 170064715) has the molecular formula C7H8N3+ and a molecular weight of 134.16 g/mol. Its IUPAC name is methylidyne-[2-[(Z)-prop-1-enyl]imidazol-1-yl]azanium.

Molecular Properties

Compound Namemethylidyne-[2-[(Z)-prop-1-enyl]imidazol-1-yl]azanium
PubChem CID170064715
Molecular FormulaC7H8N3+
Molecular Weight134.16 g/mol
Exact Mass134.07
IUPAC Namemethylidyne-[2-[(Z)-prop-1-enyl]imidazol-1-yl]azanium
SMILESC#[N+]n1ccnc1/C=C\C
InChIInChI=1S/C7H8N3/c1-3-4-7-9-5-6-10(7)8-2/h2-6H,1H3/q+1/b4-3-
InChIKeyCWEWSLDTIUFIRO-ARJAWSKDSA-N
XLogP1.64
TPSA22.18 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.16
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze methylidyne-[2-[(Z)-prop-1-enyl]imidazol-1-yl]azanium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of methylidyne-[2-[(Z)-prop-1-enyl]imidazol-1-yl]azanium?
The IUPAC name of methylidyne-[2-[(Z)-prop-1-enyl]imidazol-1-yl]azanium (CID 170064715) is methylidyne-[2-[(Z)-prop-1-enyl]imidazol-1-yl]azanium.
What is the SMILES notation for methylidyne-[2-[(Z)-prop-1-enyl]imidazol-1-yl]azanium?
The canonical SMILES for methylidyne-[2-[(Z)-prop-1-enyl]imidazol-1-yl]azanium is C#[N+]n1ccnc1/C=C\C.
What is the InChIKey of methylidyne-[2-[(Z)-prop-1-enyl]imidazol-1-yl]azanium?
The InChIKey is CWEWSLDTIUFIRO-ARJAWSKDSA-N. The full InChI is InChI=1S/C7H8N3/c1-3-4-7-9-5-6-10(7)8-2/h2-6H,1H3/q+1/b4-3-.
What are the key properties of methylidyne-[2-[(Z)-prop-1-enyl]imidazol-1-yl]azanium?
methylidyne-[2-[(Z)-prop-1-enyl]imidazol-1-yl]azanium has a molecular weight of 134.16 g/mol, XLogP of 1.64, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methylidyne-[2-[(Z)-prop-1-enyl]imidazol-1-yl]azanium is sourced from PubChem (CID 170064715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).