N-[(Z)-(6-methylidenecyclohexa-2,4-dien-1-ylidene)amino]ethenamine

C9H10N2 — CID 134350943

IUPACN-[(Z)-(6-methylidenecyclohexa-2,4-dien-1-ylidene)amino]ethenamine
SMILESC=CN/N=C1/C=CC=CC1=C
InChIInChI=1S/C9H10N2/c1-3-10-11-9-7-5-4-6-8(9)2/h3-7,10H,1-2H2/b11-9-
InChIKeyONVHMZGUZALKMY-LUAWRHEFSA-N
MW146.19 g/mol
LogP1.76
Rot. Bonds2

About N-[(Z)-(6-methylidenecyclohexa-2,4-dien-1-ylidene)amino]ethenamine

N-[(Z)-(6-methylidenecyclohexa-2,4-dien-1-ylidene)amino]ethenamine (PubChem CID 134350943) has the molecular formula C9H10N2 and a molecular weight of 146.19 g/mol. Its IUPAC name is N-[(Z)-(6-methylidenecyclohexa-2,4-dien-1-ylidene)amino]ethenamine.

Molecular Properties

Compound NameN-[(Z)-(6-methylidenecyclohexa-2,4-dien-1-ylidene)amino]ethenamine
PubChem CID134350943
Molecular FormulaC9H10N2
Molecular Weight146.19 g/mol
Exact Mass146.08
IUPAC NameN-[(Z)-(6-methylidenecyclohexa-2,4-dien-1-ylidene)amino]ethenamine
SMILESC=CN/N=C1/C=CC=CC1=C
InChIInChI=1S/C9H10N2/c1-3-10-11-9-7-5-4-6-8(9)2/h3-7,10H,1-2H2/b11-9-
InChIKeyONVHMZGUZALKMY-LUAWRHEFSA-N
XLogP1.76
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[(Z)-(6-methylidenecyclohexa-2,4-dien-1-ylidene)amino]ethenamine 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 N-[(Z)-(6-methylidenecyclohexa-2,4-dien-1-ylidene)amino]ethenamine?
The IUPAC name of N-[(Z)-(6-methylidenecyclohexa-2,4-dien-1-ylidene)amino]ethenamine (CID 134350943) is N-[(Z)-(6-methylidenecyclohexa-2,4-dien-1-ylidene)amino]ethenamine.
What is the SMILES notation for N-[(Z)-(6-methylidenecyclohexa-2,4-dien-1-ylidene)amino]ethenamine?
The canonical SMILES for N-[(Z)-(6-methylidenecyclohexa-2,4-dien-1-ylidene)amino]ethenamine is C=CN/N=C1/C=CC=CC1=C.
What is the InChIKey of N-[(Z)-(6-methylidenecyclohexa-2,4-dien-1-ylidene)amino]ethenamine?
The InChIKey is ONVHMZGUZALKMY-LUAWRHEFSA-N. The full InChI is InChI=1S/C9H10N2/c1-3-10-11-9-7-5-4-6-8(9)2/h3-7,10H,1-2H2/b11-9-.
What are the key properties of N-[(Z)-(6-methylidenecyclohexa-2,4-dien-1-ylidene)amino]ethenamine?
N-[(Z)-(6-methylidenecyclohexa-2,4-dien-1-ylidene)amino]ethenamine has a molecular weight of 146.19 g/mol, XLogP of 1.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(6-methylidenecyclohexa-2,4-dien-1-ylidene)amino]ethenamine is sourced from PubChem (CID 134350943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).