manganese(2+);bis(propan-2-yl-[(Z)-4-propan-2-yliminopent-2-en-2-yl]azanide)

C22H42MnN4 — CID 162407548

IUPACmanganese(2+);bis(propan-2-yl-[(Z)-4-propan-2-yliminopent-2-en-2-yl]azanide)
SMILESC/C(=C/C(C)=N/C(C)C)[N-]C(C)C.C/C(=C/C(C)=N\C(C)C)[N-]C(C)C.[Mn+2]
InChIInChI=1S/2C11H21N2.Mn/c2*1-8(2)12-10(5)7-11(6)13-9(3)4;/h2*7-9H,1-6H3;/q2*-1;+2/b10-7-,13-11+;10-7-,13-11-;
InChIKeyUTNBKODYSPVJTI-GDZZJYADSA-N
MW417.54 g/mol
LogP7.08
Rot. Bonds8

About manganese(2+);bis(propan-2-yl-[(Z)-4-propan-2-yliminopent-2-en-2-yl]azanide)

manganese(2+);bis(propan-2-yl-[(Z)-4-propan-2-yliminopent-2-en-2-yl]azanide) (PubChem CID 162407548) has the molecular formula C22H42MnN4 and a molecular weight of 417.54 g/mol. Its IUPAC name is manganese(2+);bis(propan-2-yl-[(Z)-4-propan-2-yliminopent-2-en-2-yl]azanide).

Molecular Properties

Compound Namemanganese(2+);bis(propan-2-yl-[(Z)-4-propan-2-yliminopent-2-en-2-yl]azanide)
PubChem CID162407548
Molecular FormulaC22H42MnN4
Molecular Weight417.54 g/mol
Exact Mass417.28
IUPAC Namemanganese(2+);bis(propan-2-yl-[(Z)-4-propan-2-yliminopent-2-en-2-yl]azanide)
SMILESC/C(=C/C(C)=N/C(C)C)[N-]C(C)C.C/C(=C/C(C)=N\C(C)C)[N-]C(C)C.[Mn+2]
InChIInChI=1S/2C11H21N2.Mn/c2*1-8(2)12-10(5)7-11(6)13-9(3)4;/h2*7-9H,1-6H3;/q2*-1;+2/b10-7-,13-11+;10-7-,13-11-;
InChIKeyUTNBKODYSPVJTI-GDZZJYADSA-N
XLogP7.08
TPSA52.92 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500417.54
LogP ≤ 57.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

CID 139102046
CID 139102046
CID 139102048
CID 139102048
CID 139102050
CID 139102050
Bis(4-N-methylimino-2-N-methylamino-2-pentene)bis(dimethylamido) zirconium(IV)
CID 139130801
Bis(4-N-methylimino-2-methylamino-2-pentene)bis(ethylamido) zirconium
CID 139130802
manganese(2+);bis(methyl-[(Z)-4-methyliminopent-2-en-2-yl]azanide)
CID 162406733
bis(tert-butyl-[(Z)-4-tert-butyliminopent-2-en-2-yl]azanide);manganese(2+)
CID 162410087
tris(ethyl-[(Z)-4-ethyliminopent-2-en-2-yl]azanide);titanium(3+)
CID 59137868
Ethyl-[4-[ethyl(methyl)amino]pent-3-en-2-ylidene]-methylazanium
CID 123564650
1,5,7-Tri(butan-2-yl)-2,4,8,10-tetramethyl-11-propyl-1,7-diaza-5,11-diazonia-6-silaspiro[5.5]undeca-2,4,8,10-tetraene
CID 123778578
tris(dimethylazanide);propan-2-yl-[(Z)-4-propan-2-yliminopent-2-en-2-yl]azanide;zirconium(4+)
CID 140545989
(Z)-N-diethylalumanyl-N-ethyl-4-ethyliminopent-2-en-2-amine
CID 148722617

Frequently Asked Questions

What is the IUPAC name of manganese(2+);bis(propan-2-yl-[(Z)-4-propan-2-yliminopent-2-en-2-yl]azanide)?
The IUPAC name of manganese(2+);bis(propan-2-yl-[(Z)-4-propan-2-yliminopent-2-en-2-yl]azanide) (CID 162407548) is manganese(2+);bis(propan-2-yl-[(Z)-4-propan-2-yliminopent-2-en-2-yl]azanide).
What is the SMILES notation for manganese(2+);bis(propan-2-yl-[(Z)-4-propan-2-yliminopent-2-en-2-yl]azanide)?
The canonical SMILES for manganese(2+);bis(propan-2-yl-[(Z)-4-propan-2-yliminopent-2-en-2-yl]azanide) is C/C(=C/C(C)=N/C(C)C)[N-]C(C)C.C/C(=C/C(C)=N\C(C)C)[N-]C(C)C.[Mn+2].
What is the InChIKey of manganese(2+);bis(propan-2-yl-[(Z)-4-propan-2-yliminopent-2-en-2-yl]azanide)?
The InChIKey is UTNBKODYSPVJTI-GDZZJYADSA-N. The full InChI is InChI=1S/2C11H21N2.Mn/c2*1-8(2)12-10(5)7-11(6)13-9(3)4;/h2*7-9H,1-6H3;/q2*-1;+2/b10-7-,13-11+;10-7-,13-11-;.
What are the key properties of manganese(2+);bis(propan-2-yl-[(Z)-4-propan-2-yliminopent-2-en-2-yl]azanide)?
manganese(2+);bis(propan-2-yl-[(Z)-4-propan-2-yliminopent-2-en-2-yl]azanide) has a molecular weight of 417.54 g/mol, XLogP of 7.08, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for manganese(2+);bis(propan-2-yl-[(Z)-4-propan-2-yliminopent-2-en-2-yl]azanide) is sourced from PubChem (CID 162407548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).