manganese;(6Z)-6-[[2-[2-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one

C18H21MnN3O2 — CID 5494066

IUPACmanganese;(6Z)-6-[[2-[2-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one
SMILESO=C1C=CC=C/C1=C/NCCNCCN/C=C1/C=CC=CC1=O.[Mn]
InChIInChI=1S/C18H21N3O2.Mn/c22-17-7-3-1-5-15(17)13-20-11-9-19-10-12-21-14-16-6-2-4-8-18(16)23;/h1-8,13-14,19-21H,9-12H2;/b15-13-,16-14-;
InChIKeyRZMPJGCPVDAUKF-MWEBDPMNSA-N
MW366.32 g/mol
LogP0.91
Rot. Bonds8

About manganese;(6Z)-6-[[2-[2-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one

manganese;(6Z)-6-[[2-[2-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one (PubChem CID 5494066) has the molecular formula C18H21MnN3O2 and a molecular weight of 366.32 g/mol. Its IUPAC name is manganese;(6Z)-6-[[2-[2-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one.

Molecular Properties

Compound Namemanganese;(6Z)-6-[[2-[2-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one
PubChem CID5494066
Molecular FormulaC18H21MnN3O2
Molecular Weight366.32 g/mol
Exact Mass366.10
IUPAC Namemanganese;(6Z)-6-[[2-[2-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one
SMILESO=C1C=CC=C/C1=C/NCCNCCN/C=C1/C=CC=CC1=O.[Mn]
InChIInChI=1S/C18H21N3O2.Mn/c22-17-7-3-1-5-15(17)13-20-11-9-19-10-12-21-14-16-6-2-4-8-18(16)23;/h1-8,13-14,19-21H,9-12H2;/b15-13-,16-14-;
InChIKeyRZMPJGCPVDAUKF-MWEBDPMNSA-N
XLogP0.91
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.32
LogP ≤ 50.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze manganese;(6Z)-6-[[2-[2-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one 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 manganese;(6Z)-6-[[2-[2-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one?
The IUPAC name of manganese;(6Z)-6-[[2-[2-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one (CID 5494066) is manganese;(6Z)-6-[[2-[2-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one.
What is the SMILES notation for manganese;(6Z)-6-[[2-[2-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one?
The canonical SMILES for manganese;(6Z)-6-[[2-[2-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one is O=C1C=CC=C/C1=C/NCCNCCN/C=C1/C=CC=CC1=O.[Mn].
What is the InChIKey of manganese;(6Z)-6-[[2-[2-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one?
The InChIKey is RZMPJGCPVDAUKF-MWEBDPMNSA-N. The full InChI is InChI=1S/C18H21N3O2.Mn/c22-17-7-3-1-5-15(17)13-20-11-9-19-10-12-21-14-16-6-2-4-8-18(16)23;/h1-8,13-14,19-21H,9-12H2;/b15-13-,16-14-;.
What are the key properties of manganese;(6Z)-6-[[2-[2-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one?
manganese;(6Z)-6-[[2-[2-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one has a molecular weight of 366.32 g/mol, XLogP of 0.91, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for manganese;(6Z)-6-[[2-[2-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one is sourced from PubChem (CID 5494066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).