6-methylidene-N-[(Z)-prop-1-enyl]cyclohexa-2,4-dien-1-imine

C10H11N — CID 89028721

IUPAC6-methylidene-N-[(Z)-prop-1-enyl]cyclohexa-2,4-dien-1-imine
SMILESC=C1C=CC=C/C1=N\C=C/C
InChIInChI=1S/C10H11N/c1-3-8-11-10-7-5-4-6-9(10)2/h3-8H,2H2,1H3/b8-3-,11-10+
InChIKeyGFDIRJUZKJSLBH-VQWHTZHVSA-N
MW145.20 g/mol
LogP2.64
Rot. Bonds1

About 6-methylidene-N-[(Z)-prop-1-enyl]cyclohexa-2,4-dien-1-imine

6-methylidene-N-[(Z)-prop-1-enyl]cyclohexa-2,4-dien-1-imine (PubChem CID 89028721) has the molecular formula C10H11N and a molecular weight of 145.20 g/mol. Its IUPAC name is 6-methylidene-N-[(Z)-prop-1-enyl]cyclohexa-2,4-dien-1-imine.

Molecular Properties

Compound Name6-methylidene-N-[(Z)-prop-1-enyl]cyclohexa-2,4-dien-1-imine
PubChem CID89028721
Molecular FormulaC10H11N
Molecular Weight145.20 g/mol
Exact Mass145.09
IUPAC Name6-methylidene-N-[(Z)-prop-1-enyl]cyclohexa-2,4-dien-1-imine
SMILESC=C1C=CC=C/C1=N\C=C/C
InChIInChI=1S/C10H11N/c1-3-8-11-10-7-5-4-6-9(10)2/h3-8H,2H2,1H3/b8-3-,11-10+
InChIKeyGFDIRJUZKJSLBH-VQWHTZHVSA-N
XLogP2.64
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-methylidene-N-[(Z)-prop-1-enyl]cyclohexa-2,4-dien-1-imine?
The IUPAC name of 6-methylidene-N-[(Z)-prop-1-enyl]cyclohexa-2,4-dien-1-imine (CID 89028721) is 6-methylidene-N-[(Z)-prop-1-enyl]cyclohexa-2,4-dien-1-imine.
What is the SMILES notation for 6-methylidene-N-[(Z)-prop-1-enyl]cyclohexa-2,4-dien-1-imine?
The canonical SMILES for 6-methylidene-N-[(Z)-prop-1-enyl]cyclohexa-2,4-dien-1-imine is C=C1C=CC=C/C1=N\C=C/C.
What is the InChIKey of 6-methylidene-N-[(Z)-prop-1-enyl]cyclohexa-2,4-dien-1-imine?
The InChIKey is GFDIRJUZKJSLBH-VQWHTZHVSA-N. The full InChI is InChI=1S/C10H11N/c1-3-8-11-10-7-5-4-6-9(10)2/h3-8H,2H2,1H3/b8-3-,11-10+.
What are the key properties of 6-methylidene-N-[(Z)-prop-1-enyl]cyclohexa-2,4-dien-1-imine?
6-methylidene-N-[(Z)-prop-1-enyl]cyclohexa-2,4-dien-1-imine has a molecular weight of 145.20 g/mol, XLogP of 2.64, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylidene-N-[(Z)-prop-1-enyl]cyclohexa-2,4-dien-1-imine is sourced from PubChem (CID 89028721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).