copper bis(methyl-[(Z)-4-(2-methylpropylimino)pent-2-en-2-yl]azanide)

C20H38CuN4 — CID 139121718

IUPACcopper bis(methyl-[(Z)-4-(2-methylpropylimino)pent-2-en-2-yl]azanide)
SMILESC[N-]/C(C)=C\C(C)=N\CC(C)C.C[N-]/C(C)=C\C(C)=N\CC(C)C.[Cu+2]
InChIInChI=1S/2C10H19N2.Cu/c2*1-8(2)7-12-10(4)6-9(3)11-5;/h2*6,8H,7H2,1-5H3;/q2*-1;+2/b2*9-6-,12-10+;
InChIKeyASNAWWGPSCUEGC-RJSWYMSASA-N
MW398.10 g/mol
LogP6.02
Rot. Bonds8

About copper bis(methyl-[(Z)-4-(2-methylpropylimino)pent-2-en-2-yl]azanide)

copper bis(methyl-[(Z)-4-(2-methylpropylimino)pent-2-en-2-yl]azanide) (PubChem CID 139121718) has the molecular formula C20H38CuN4 and a molecular weight of 398.10 g/mol. Its IUPAC name is copper bis(methyl-[(Z)-4-(2-methylpropylimino)pent-2-en-2-yl]azanide).

Molecular Properties

Compound Namecopper bis(methyl-[(Z)-4-(2-methylpropylimino)pent-2-en-2-yl]azanide)
PubChem CID139121718
Molecular FormulaC20H38CuN4
Molecular Weight398.10 g/mol
Exact Mass397.24
IUPAC Namecopper bis(methyl-[(Z)-4-(2-methylpropylimino)pent-2-en-2-yl]azanide)
SMILESC[N-]/C(C)=C\C(C)=N\CC(C)C.C[N-]/C(C)=C\C(C)=N\CC(C)C.[Cu+2]
InChIInChI=1S/2C10H19N2.Cu/c2*1-8(2)7-12-10(4)6-9(3)11-5;/h2*6,8H,7H2,1-5H3;/q2*-1;+2/b2*9-6-,12-10+;
InChIKeyASNAWWGPSCUEGC-RJSWYMSASA-N
XLogP6.02
TPSA52.92 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500398.10
LogP ≤ 56.02
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
dicopper;[(Z)-4-ethyliminopent-2-en-2-yl]-methylazanide;tris(ethyl-[(Z)-4-methyliminopent-2-en-2-yl]azanide)
CID 139121717
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
tris(ethyl-[(Z)-4-ethyliminopent-2-en-2-yl]azanide);titanium(3+)
CID 59137868
tris(dimethylazanide);propan-2-yl-[(Z)-4-propan-2-yliminopent-2-en-2-yl]azanide;zirconium(4+)
CID 140545989
2,2-Dimethylpropyl-[4-(2,2-dimethylpropylazanidyl)-3,6-bis(2,2-dimethylpropylimino)cyclohexa-1,4-dien-1-yl]azanide
CID 102076123
methyl-[(Z)-4-(2-methylpropylimino)pent-2-en-2-yl]azanide
CID 177624525

Frequently Asked Questions

What is the IUPAC name of copper bis(methyl-[(Z)-4-(2-methylpropylimino)pent-2-en-2-yl]azanide)?
The IUPAC name of copper bis(methyl-[(Z)-4-(2-methylpropylimino)pent-2-en-2-yl]azanide) (CID 139121718) is copper bis(methyl-[(Z)-4-(2-methylpropylimino)pent-2-en-2-yl]azanide).
What is the SMILES notation for copper bis(methyl-[(Z)-4-(2-methylpropylimino)pent-2-en-2-yl]azanide)?
The canonical SMILES for copper bis(methyl-[(Z)-4-(2-methylpropylimino)pent-2-en-2-yl]azanide) is C[N-]/C(C)=C\C(C)=N\CC(C)C.C[N-]/C(C)=C\C(C)=N\CC(C)C.[Cu+2].
What is the InChIKey of copper bis(methyl-[(Z)-4-(2-methylpropylimino)pent-2-en-2-yl]azanide)?
The InChIKey is ASNAWWGPSCUEGC-RJSWYMSASA-N. The full InChI is InChI=1S/2C10H19N2.Cu/c2*1-8(2)7-12-10(4)6-9(3)11-5;/h2*6,8H,7H2,1-5H3;/q2*-1;+2/b2*9-6-,12-10+;.
What are the key properties of copper bis(methyl-[(Z)-4-(2-methylpropylimino)pent-2-en-2-yl]azanide)?
copper bis(methyl-[(Z)-4-(2-methylpropylimino)pent-2-en-2-yl]azanide) has a molecular weight of 398.10 g/mol, XLogP of 6.02, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for copper bis(methyl-[(Z)-4-(2-methylpropylimino)pent-2-en-2-yl]azanide) is sourced from PubChem (CID 139121718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).