CID 139170209

C21H41Cl2Ge2N3Si2 — CID 139170209

IUPAC—
SMILESCC(C)(C)/N=C(\c1ccccc1)N([Ge]N([Si](C)(C)C)[Si](C)(C)C)C(C)(C)C.Cl[Ge]Cl
InChIInChI=1S/C21H41GeN3Si2.Cl2Ge/c1-20(2,3)23-19(18-16-14-13-15-17-18)24(21(4,5)6)22-25(26(7,8)9)27(10,11)12;1-3-2/h13-17H,1-12H3;/b23-19+;
InChIKeyKAWCOIUMYJMFDS-IMPZXOFZSA-N
MW607.88 g/mol
LogP6.84
Rot. Bonds5

About CID 139170209

CID 139170209 (PubChem CID 139170209) has the molecular formula C21H41Cl2Ge2N3Si2 and a molecular weight of 607.88 g/mol.

Molecular Properties

Compound NameCID 139170209
PubChem CID139170209
Molecular FormulaC21H41Cl2Ge2N3Si2
Molecular Weight607.88 g/mol
Exact Mass609.06
IUPAC Name—
SMILESCC(C)(C)/N=C(\c1ccccc1)N([Ge]N([Si](C)(C)C)[Si](C)(C)C)C(C)(C)C.Cl[Ge]Cl
InChIInChI=1S/C21H41GeN3Si2.Cl2Ge/c1-20(2,3)23-19(18-16-14-13-15-17-18)24(21(4,5)6)22-25(26(7,8)9)27(10,11)12;1-3-2/h13-17H,1-12H3;/b23-19+;
InChIKeyKAWCOIUMYJMFDS-IMPZXOFZSA-N
XLogP6.84
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500607.88
LogP ≤ 56.84
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': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N-tert-butyl-1,1-diphenylmethan(15N)imine
CID 170780662
N-tert-butyl-2,2-dimethyl-1-phenylpropan-1-imine
CID 15739864
N,N,N'-tris(trimethylsilyl)benzenecarboximidamide
CID 18461962
N-tert-butyl-1-phenylpropan-1-imine
CID 12694730
N-(N-tert-butyl-C-phenylcarbonimidoyl)-2,2-dimethylpropanamide
CID 11118811
bis((Z)-3-tert-butylimino-1,3-diphenylprop-1-en-1-olate);bis(dichloromethane);bis(oxygen(2-));uranium
CID 139135762
N-[(Z)-[(4Z)-4-[methyl(trimethylsilyl)hydrazinylidene]-1,4-diphenylbutylidene]amino]-N-trimethylsilylmethanamine
CID 89456050
N,2-dimethyl-N-(1-phenylethenyl)propan-2-amine;ethane
CID 159340519
N-tert-butyl-1-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-1-phenylmethanimine;dibromonickel
CID 140820888
N-[(benzhydrylideneamino)-chloro-methylsilyl]-1,1-diphenylmethanimine
CID 102116978
benzoic acid;tert-butyl-hydroxy-dimethylsilane
CID 71403721
N'-tert-butyl-N-(3-cyano-4-methylphenyl)benzenecarboximidamide
CID 132538491

Frequently Asked Questions

What is the IUPAC name of CID 139170209?
The IUPAC name of CID 139170209 (CID 139170209) is not available.
What is the SMILES notation for CID 139170209?
The canonical SMILES for CID 139170209 is CC(C)(C)/N=C(\c1ccccc1)N([Ge]N([Si](C)(C)C)[Si](C)(C)C)C(C)(C)C.Cl[Ge]Cl.
What is the InChIKey of CID 139170209?
The InChIKey is KAWCOIUMYJMFDS-IMPZXOFZSA-N. The full InChI is InChI=1S/C21H41GeN3Si2.Cl2Ge/c1-20(2,3)23-19(18-16-14-13-15-17-18)24(21(4,5)6)22-25(26(7,8)9)27(10,11)12;1-3-2/h13-17H,1-12H3;/b23-19+;.
What are the key properties of CID 139170209?
CID 139170209 has a molecular weight of 607.88 g/mol, XLogP of 6.84, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 139170209 is sourced from PubChem (CID 139170209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).