N-[(benzhydrylideneamino)-chloro-methylsilyl]-1,1-diphenylmethanimine

C27H23ClN2Si — CID 102116978

IUPACN-[(benzhydrylideneamino)-chloro-methylsilyl]-1,1-diphenylmethanimine
SMILESC[Si](Cl)(N=C(c1ccccc1)c1ccccc1)N=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C27H23ClN2Si/c1-31(28,29-26(22-14-6-2-7-15-22)23-16-8-3-9-17-23)30-27(24-18-10-4-11-19-24)25-20-12-5-13-21-25/h2-21H,1H3
InChIKeyOKGZKIYABYIBJA-UHFFFAOYSA-N
MW439.03 g/mol
LogP6.87
Rot. Bonds6

About N-[(benzhydrylideneamino)-chloro-methylsilyl]-1,1-diphenylmethanimine

N-[(benzhydrylideneamino)-chloro-methylsilyl]-1,1-diphenylmethanimine (PubChem CID 102116978) has the molecular formula C27H23ClN2Si and a molecular weight of 439.03 g/mol. Its IUPAC name is N-[(benzhydrylideneamino)-chloro-methylsilyl]-1,1-diphenylmethanimine.

Molecular Properties

Compound NameN-[(benzhydrylideneamino)-chloro-methylsilyl]-1,1-diphenylmethanimine
PubChem CID102116978
Molecular FormulaC27H23ClN2Si
Molecular Weight439.03 g/mol
Exact Mass438.13
IUPAC NameN-[(benzhydrylideneamino)-chloro-methylsilyl]-1,1-diphenylmethanimine
SMILESC[Si](Cl)(N=C(c1ccccc1)c1ccccc1)N=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C27H23ClN2Si/c1-31(28,29-26(22-14-6-2-7-15-22)23-16-8-3-9-17-23)30-27(24-18-10-4-11-19-24)25-20-12-5-13-21-25/h2-21H,1H3
InChIKeyOKGZKIYABYIBJA-UHFFFAOYSA-N
XLogP6.87
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500439.03
LogP ≤ 56.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-(benzhydrylideneamino)ethanimidamide
CID 11128320
4-[(Z)-N-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]-C-phenylcarbonimidoyl]aniline
CID 6871279
2-[(E)-N-(benzhydrylideneamino)-C-methylcarbonimidoyl]phenol
CID 135775332
(NE,E)-N-[chloro(phenyl)methylidene]benzenecarbohydrazonoyl chloride
CID 6141172
N-tert-butyl-1,1-diphenylmethan(15N)imine
CID 170780662
(Z)-N-(benzhydrylideneamino)-3,3,4,4,4-pentafluorobutan-2-imine
CID 118579349
N-(benzhydrylideneamino)benzenecarboximidoyl cyanide
CID 165353120
1-(benzhydrylideneamino)ethylidenechromium
CID 11463699
(Z)-1-[4-[tert-butyl(diphenyl)silyl]oxyphenyl]-1-phenyl-N-trimethylsilylmethanimine
CID 140756079
1-N,3-N-bis(benzhydrylideneamino)indene-1,3-diimine
CID 4075236
N,N,N'-tris(trimethylsilyl)benzenecarboximidamide
CID 18461962
N-(benzhydrylideneamino)-1-(3,4-dimethylphenyl)ethanimine
CID 4649996

Frequently Asked Questions

What is the IUPAC name of N-[(benzhydrylideneamino)-chloro-methylsilyl]-1,1-diphenylmethanimine?
The IUPAC name of N-[(benzhydrylideneamino)-chloro-methylsilyl]-1,1-diphenylmethanimine (CID 102116978) is N-[(benzhydrylideneamino)-chloro-methylsilyl]-1,1-diphenylmethanimine.
What is the SMILES notation for N-[(benzhydrylideneamino)-chloro-methylsilyl]-1,1-diphenylmethanimine?
The canonical SMILES for N-[(benzhydrylideneamino)-chloro-methylsilyl]-1,1-diphenylmethanimine is C[Si](Cl)(N=C(c1ccccc1)c1ccccc1)N=C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[(benzhydrylideneamino)-chloro-methylsilyl]-1,1-diphenylmethanimine?
The InChIKey is OKGZKIYABYIBJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H23ClN2Si/c1-31(28,29-26(22-14-6-2-7-15-22)23-16-8-3-9-17-23)30-27(24-18-10-4-11-19-24)25-20-12-5-13-21-25/h2-21H,1H3.
What are the key properties of N-[(benzhydrylideneamino)-chloro-methylsilyl]-1,1-diphenylmethanimine?
N-[(benzhydrylideneamino)-chloro-methylsilyl]-1,1-diphenylmethanimine has a molecular weight of 439.03 g/mol, XLogP of 6.87, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(benzhydrylideneamino)-chloro-methylsilyl]-1,1-diphenylmethanimine is sourced from PubChem (CID 102116978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).