N-[(Z)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]methanimine

C10H11N — CID 130456704

IUPACN-[(Z)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]methanimine
SMILESC=N/C=c1/cccc/c1=C/C
InChIInChI=1S/C10H11N/c1-3-9-6-4-5-7-10(9)8-11-2/h3-8H,2H2,1H3/b9-3-,10-8-
InChIKeyZBNQUJVSEWUQQC-HJZYTUDGSA-N
MW145.20 g/mol
LogP0.93
Rot. Bonds1

About N-[(Z)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]methanimine

N-[(Z)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]methanimine (PubChem CID 130456704) has the molecular formula C10H11N and a molecular weight of 145.20 g/mol. Its IUPAC name is N-[(Z)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]methanimine.

Molecular Properties

Compound NameN-[(Z)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]methanimine
PubChem CID130456704
Molecular FormulaC10H11N
Molecular Weight145.20 g/mol
Exact Mass145.09
IUPAC NameN-[(Z)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]methanimine
SMILESC=N/C=c1/cccc/c1=C/C
InChIInChI=1S/C10H11N/c1-3-9-6-4-5-7-10(9)8-11-2/h3-8H,2H2,1H3/b9-3-,10-8-
InChIKeyZBNQUJVSEWUQQC-HJZYTUDGSA-N
XLogP0.93
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 ≤ 50.93
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 N-[(Z)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]methanimine?
The IUPAC name of N-[(Z)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]methanimine (CID 130456704) is N-[(Z)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]methanimine.
What is the SMILES notation for N-[(Z)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]methanimine?
The canonical SMILES for N-[(Z)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]methanimine is C=N/C=c1/cccc/c1=C/C.
What is the InChIKey of N-[(Z)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]methanimine?
The InChIKey is ZBNQUJVSEWUQQC-HJZYTUDGSA-N. The full InChI is InChI=1S/C10H11N/c1-3-9-6-4-5-7-10(9)8-11-2/h3-8H,2H2,1H3/b9-3-,10-8-.
What are the key properties of N-[(Z)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]methanimine?
N-[(Z)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]methanimine has a molecular weight of 145.20 g/mol, XLogP of 0.93, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]methyl]methanimine is sourced from PubChem (CID 130456704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).