N-[[3,4-bis[benzyl(trimethylsilyl)hydrazinylidene]cyclohexylidene]amino]-1-phenyl-N-trimethylsilylmethanamine

C36H54N6Si3 — CID 89455826

IUPACN-[[3,4-bis[benzyl(trimethylsilyl)hydrazinylidene]cyclohexylidene]amino]-1-phenyl-N-trimethylsilylmethanamine
SMILESC[Si](C)(C)N(Cc1ccccc1)N=C1CCC(=NN(Cc2ccccc2)[Si](C)(C)C)C(=NN(Cc2ccccc2)[Si](C)(C)C)C1
InChIInChI=1S/C36H54N6Si3/c1-43(2,3)40(28-31-19-13-10-14-20-31)37-34-25-26-35(38-41(44(4,5)6)29-32-21-15-11-16-22-32)36(27-34)39-42(45(7,8)9)30-33-23-17-12-18-24-33/h10-24H,25-30H2,1-9H3
InChIKeyOBMUXNQKWPUITD-UHFFFAOYSA-N
MW655.13 g/mol
LogP9.25
Rot. Bonds12

About N-[[3,4-bis[benzyl(trimethylsilyl)hydrazinylidene]cyclohexylidene]amino]-1-phenyl-N-trimethylsilylmethanamine

N-[[3,4-bis[benzyl(trimethylsilyl)hydrazinylidene]cyclohexylidene]amino]-1-phenyl-N-trimethylsilylmethanamine (PubChem CID 89455826) has the molecular formula C36H54N6Si3 and a molecular weight of 655.13 g/mol. Its IUPAC name is N-[[3,4-bis[benzyl(trimethylsilyl)hydrazinylidene]cyclohexylidene]amino]-1-phenyl-N-trimethylsilylmethanamine.

Molecular Properties

Compound NameN-[[3,4-bis[benzyl(trimethylsilyl)hydrazinylidene]cyclohexylidene]amino]-1-phenyl-N-trimethylsilylmethanamine
PubChem CID89455826
Molecular FormulaC36H54N6Si3
Molecular Weight655.13 g/mol
Exact Mass654.37
IUPAC NameN-[[3,4-bis[benzyl(trimethylsilyl)hydrazinylidene]cyclohexylidene]amino]-1-phenyl-N-trimethylsilylmethanamine
SMILESC[Si](C)(C)N(Cc1ccccc1)N=C1CCC(=NN(Cc2ccccc2)[Si](C)(C)C)C(=NN(Cc2ccccc2)[Si](C)(C)C)C1
InChIInChI=1S/C36H54N6Si3/c1-43(2,3)40(28-31-19-13-10-14-20-31)37-34-25-26-35(38-41(44(4,5)6)29-32-21-15-11-16-22-32)36(27-34)39-42(45(7,8)9)30-33-23-17-12-18-24-33/h10-24H,25-30H2,1-9H3
InChIKeyOBMUXNQKWPUITD-UHFFFAOYSA-N
XLogP9.25
TPSA46.80 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500655.13
LogP ≤ 59.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_one_A(321)', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-[[3,4-bis[benzyl(trimethylsilyl)hydrazinylidene]cyclohexylidene]amino]-1-phenyl-N-trimethylsilylmethanamine with MolForge

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Related Compounds

bis([(Z,3Z)-1,3-diphenyl-3-trimethylsilyliminoprop-1-enyl]-trimethylsilylazanide);ytterbium(2+)
CID 139155113
N-[(E)-[(5Z)-5-[benzyl(trimethylsilyl)hydrazinylidene]-5-phenylpentan-2-ylidene]amino]-1-phenyl-N-trimethylsilylmethanamine
CID 89455639
N-[(E)-[(4E)-4-[benzyl(trimethylsilyl)hydrazinylidene]butylidene]amino]-1-phenyl-N-trimethylsilylmethanamine
CID 89455641
N-[(Z)-[(2E)-2-[benzyl(trimethylsilyl)hydrazinylidene]cyclohexylidene]amino]-1-phenyl-N-trimethylsilylmethanamine
CID 89455897
N-[[2-[benzyl(trimethylsilyl)hydrazinylidene]cyclohexylidene]amino]-1-phenyl-N-trimethylsilylmethanamine
CID 89455899
N-[(E)-[3-[(E)-[benzyl(trimethylsilyl)hydrazinylidene]methyl]phenyl]methylideneamino]-1-phenyl-N-trimethylsilylmethanamine
CID 89455900
N-benzyl-N-[(E)-[(4E)-4-(dibenzylhydrazinylidene)pentan-2-ylidene]amino]-1-phenylmethanamine
CID 89455913
N-benzyl-N-[(E)-[(5E)-5-(dibenzylhydrazinylidene)hexan-2-ylidene]amino]-1-phenylmethanamine
CID 89455930
N-benzyl-N-[(E)-[(3E)-3-(dibenzylhydrazinylidene)pentan-2-ylidene]amino]-1-phenylmethanamine
CID 89455936
N-benzyl-N-[(E)-[(3E,4Z)-3,4-bis(dibenzylhydrazinylidene)cyclohexylidene]amino]-1-phenylmethanamine
CID 89455940
N-benzyl-N-[(Z)-[(3E)-2,3-bis(dibenzylhydrazinylidene)cyclohexylidene]amino]-1-phenylmethanamine
CID 89455951
N-benzyl-N-[[2,3-bis(dibenzylhydrazinylidene)cyclohexylidene]amino]-1-phenylmethanamine
CID 89455952

Frequently Asked Questions

What is the IUPAC name of N-[[3,4-bis[benzyl(trimethylsilyl)hydrazinylidene]cyclohexylidene]amino]-1-phenyl-N-trimethylsilylmethanamine?
The IUPAC name of N-[[3,4-bis[benzyl(trimethylsilyl)hydrazinylidene]cyclohexylidene]amino]-1-phenyl-N-trimethylsilylmethanamine (CID 89455826) is N-[[3,4-bis[benzyl(trimethylsilyl)hydrazinylidene]cyclohexylidene]amino]-1-phenyl-N-trimethylsilylmethanamine.
What is the SMILES notation for N-[[3,4-bis[benzyl(trimethylsilyl)hydrazinylidene]cyclohexylidene]amino]-1-phenyl-N-trimethylsilylmethanamine?
The canonical SMILES for N-[[3,4-bis[benzyl(trimethylsilyl)hydrazinylidene]cyclohexylidene]amino]-1-phenyl-N-trimethylsilylmethanamine is C[Si](C)(C)N(Cc1ccccc1)N=C1CCC(=NN(Cc2ccccc2)[Si](C)(C)C)C(=NN(Cc2ccccc2)[Si](C)(C)C)C1.
What is the InChIKey of N-[[3,4-bis[benzyl(trimethylsilyl)hydrazinylidene]cyclohexylidene]amino]-1-phenyl-N-trimethylsilylmethanamine?
The InChIKey is OBMUXNQKWPUITD-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H54N6Si3/c1-43(2,3)40(28-31-19-13-10-14-20-31)37-34-25-26-35(38-41(44(4,5)6)29-32-21-15-11-16-22-32)36(27-34)39-42(45(7,8)9)30-33-23-17-12-18-24-33/h10-24H,25-30H2,1-9H3.
What are the key properties of N-[[3,4-bis[benzyl(trimethylsilyl)hydrazinylidene]cyclohexylidene]amino]-1-phenyl-N-trimethylsilylmethanamine?
N-[[3,4-bis[benzyl(trimethylsilyl)hydrazinylidene]cyclohexylidene]amino]-1-phenyl-N-trimethylsilylmethanamine has a molecular weight of 655.13 g/mol, XLogP of 9.25, 12 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3,4-bis[benzyl(trimethylsilyl)hydrazinylidene]cyclohexylidene]amino]-1-phenyl-N-trimethylsilylmethanamine is sourced from PubChem (CID 89455826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).