(E)-2,2-dimethyl-N-[(S)-phenyl(trimethylsilyl)methyl]propan-1-imine

C15H25NSi — CID 134905572

IUPAC(E)-2,2-dimethyl-N-[(S)-phenyl(trimethylsilyl)methyl]propan-1-imine
SMILESCC(C)(C)/C=N/[C@H](c1ccccc1)[Si](C)(C)C
InChIInChI=1S/C15H25NSi/c1-15(2,3)12-16-14(17(4,5)6)13-10-8-7-9-11-13/h7-12,14H,1-6H3/b16-12+/t14-/m0/s1
InChIKeyVDKPPGDKIATWOM-AOHITCTBSA-N
MW247.46 g/mol
LogP4.72
Rot. Bonds3

About (E)-2,2-dimethyl-N-[(S)-phenyl(trimethylsilyl)methyl]propan-1-imine

(E)-2,2-dimethyl-N-[(S)-phenyl(trimethylsilyl)methyl]propan-1-imine (PubChem CID 134905572) has the molecular formula C15H25NSi and a molecular weight of 247.46 g/mol. Its IUPAC name is (E)-2,2-dimethyl-N-[(S)-phenyl(trimethylsilyl)methyl]propan-1-imine.

Molecular Properties

Compound Name(E)-2,2-dimethyl-N-[(S)-phenyl(trimethylsilyl)methyl]propan-1-imine
PubChem CID134905572
Molecular FormulaC15H25NSi
Molecular Weight247.46 g/mol
Exact Mass247.18
IUPAC Name(E)-2,2-dimethyl-N-[(S)-phenyl(trimethylsilyl)methyl]propan-1-imine
SMILESCC(C)(C)/C=N/[C@H](c1ccccc1)[Si](C)(C)C
InChIInChI=1S/C15H25NSi/c1-15(2,3)12-16-14(17(4,5)6)13-10-8-7-9-11-13/h7-12,14H,1-6H3/b16-12+/t14-/m0/s1
InChIKeyVDKPPGDKIATWOM-AOHITCTBSA-N
XLogP4.72
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.46
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2,2-dimethyl-N-(1-phenylethyl)propan-1-imine
CID 19708107
methyl (Z)-N-[phenyl(trimethylsilyl)methyl]benzenecarboximidate
CID 11098524
[(1R)-2,2-dimethyl-1-phenylpropoxy]-trimethylsilane
CID 101471174
2,2-dimethyl-3-phenyl-3-trimethylsilylpropanoic acid
CID 174920111
(R)-[tert-butyl(dimethyl)silyl]-phenylmethanol
CID 101051972
N-[bis(trimethylsilyl)methyl]-1-phenylmethanimine
CID 71344888
N-[(1R)-1-phenylethyl]-N'-[(1S)-1-phenylethyl]ethane-1,2-diimine
CID 148629310
(E)-N-[(4R,5R)-4,5-diphenyl-1,3-dioxolan-2-yl]-2,2-dimethylpropan-1-imine
CID 11098918
(2-cyclopenta-2,4-dien-1-yl-2-methyl-1-phenylpropyl)benzene
CID 131720872
N-[benzhydryl(dimethyl)silyl]-2-methylpropan-2-amine
CID 54565291
trichloro(1-phenylbut-2-enyl)silane
CID 139646025
(E)-3-[tert-butyl(dimethyl)silyl]-1-phenylprop-2-en-1-ol
CID 10922912

Frequently Asked Questions

What is the IUPAC name of (E)-2,2-dimethyl-N-[(S)-phenyl(trimethylsilyl)methyl]propan-1-imine?
The IUPAC name of (E)-2,2-dimethyl-N-[(S)-phenyl(trimethylsilyl)methyl]propan-1-imine (CID 134905572) is (E)-2,2-dimethyl-N-[(S)-phenyl(trimethylsilyl)methyl]propan-1-imine.
What is the SMILES notation for (E)-2,2-dimethyl-N-[(S)-phenyl(trimethylsilyl)methyl]propan-1-imine?
The canonical SMILES for (E)-2,2-dimethyl-N-[(S)-phenyl(trimethylsilyl)methyl]propan-1-imine is CC(C)(C)/C=N/[C@H](c1ccccc1)[Si](C)(C)C.
What is the InChIKey of (E)-2,2-dimethyl-N-[(S)-phenyl(trimethylsilyl)methyl]propan-1-imine?
The InChIKey is VDKPPGDKIATWOM-AOHITCTBSA-N. The full InChI is InChI=1S/C15H25NSi/c1-15(2,3)12-16-14(17(4,5)6)13-10-8-7-9-11-13/h7-12,14H,1-6H3/b16-12+/t14-/m0/s1.
What are the key properties of (E)-2,2-dimethyl-N-[(S)-phenyl(trimethylsilyl)methyl]propan-1-imine?
(E)-2,2-dimethyl-N-[(S)-phenyl(trimethylsilyl)methyl]propan-1-imine has a molecular weight of 247.46 g/mol, XLogP of 4.72, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2,2-dimethyl-N-[(S)-phenyl(trimethylsilyl)methyl]propan-1-imine is sourced from PubChem (CID 134905572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).