4-methyl-N-(1,1,2-trimethoxy-3-silylpropyl)pentan-2-imine

C12H27NO3Si — CID 174942235

IUPAC4-methyl-N-(1,1,2-trimethoxy-3-silylpropyl)pentan-2-imine
SMILESCOC(C[SiH3])C(N=C(C)CC(C)C)(OC)OC
InChIInChI=1S/C12H27NO3Si/c1-9(2)7-10(3)13-12(15-5,16-6)11(8-17)14-4/h9,11H,7-8H2,1-6,17H3
InChIKeyIRMRIWHFROZUFV-UHFFFAOYSA-N
MW261.44 g/mol
LogP1.24
Rot. Bonds8

About 4-methyl-N-(1,1,2-trimethoxy-3-silylpropyl)pentan-2-imine

4-methyl-N-(1,1,2-trimethoxy-3-silylpropyl)pentan-2-imine (PubChem CID 174942235) has the molecular formula C12H27NO3Si and a molecular weight of 261.44 g/mol. Its IUPAC name is 4-methyl-N-(1,1,2-trimethoxy-3-silylpropyl)pentan-2-imine.

Molecular Properties

Compound Name4-methyl-N-(1,1,2-trimethoxy-3-silylpropyl)pentan-2-imine
PubChem CID174942235
Molecular FormulaC12H27NO3Si
Molecular Weight261.44 g/mol
Exact Mass261.18
IUPAC Name4-methyl-N-(1,1,2-trimethoxy-3-silylpropyl)pentan-2-imine
SMILESCOC(C[SiH3])C(N=C(C)CC(C)C)(OC)OC
InChIInChI=1S/C12H27NO3Si/c1-9(2)7-10(3)13-12(15-5,16-6)11(8-17)14-4/h9,11H,7-8H2,1-6,17H3
InChIKeyIRMRIWHFROZUFV-UHFFFAOYSA-N
XLogP1.24
TPSA40.05 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.44
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-tert-butyl-2,6-dimethylheptan-4-imine
CID 155787750
4-methyl-N-[1-[2-(4-methylpentan-2-ylideneamino)propoxy]propan-2-yl]pentan-2-imine
CID 58849462
4-methyl-N-[4-(4-methylpentan-2-ylideneamino)butyl]pentan-2-imine
CID 71352712
4-methyl-N-(1-trimethoxysilylbutyl)pentan-2-imine
CID 173017912
(4-methylpentan-2-ylideneamino) acetate
CID 59413828
(E)-4-methyl-N-[methyl-bis[[(Z)-4-methylpentan-2-ylideneamino]oxy]silyl]oxypentan-2-imine
CID 99771064
4-ethylidene-2,6-dimethylheptane
CID 102206987
N-methyl-3-(4-methylpentan-2-ylideneamino)-N-[3-(4-methylpentan-2-ylideneamino)propyl]propan-1-amine
CID 167613512
(E)-N-diphenylphosphinothioyl-4-methylpentan-2-imine
CID 135073200
2,4-dimethylpent-1-ene;ethane
CID 143336990
2-methoxy-7-methyloctane-3,5-dione
CID 24987129
N,N'-bis[(Z)-4-methylpentan-2-ylideneamino]pentanediamide
CID 6175559

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(1,1,2-trimethoxy-3-silylpropyl)pentan-2-imine?
The IUPAC name of 4-methyl-N-(1,1,2-trimethoxy-3-silylpropyl)pentan-2-imine (CID 174942235) is 4-methyl-N-(1,1,2-trimethoxy-3-silylpropyl)pentan-2-imine.
What is the SMILES notation for 4-methyl-N-(1,1,2-trimethoxy-3-silylpropyl)pentan-2-imine?
The canonical SMILES for 4-methyl-N-(1,1,2-trimethoxy-3-silylpropyl)pentan-2-imine is COC(C[SiH3])C(N=C(C)CC(C)C)(OC)OC.
What is the InChIKey of 4-methyl-N-(1,1,2-trimethoxy-3-silylpropyl)pentan-2-imine?
The InChIKey is IRMRIWHFROZUFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27NO3Si/c1-9(2)7-10(3)13-12(15-5,16-6)11(8-17)14-4/h9,11H,7-8H2,1-6,17H3.
What are the key properties of 4-methyl-N-(1,1,2-trimethoxy-3-silylpropyl)pentan-2-imine?
4-methyl-N-(1,1,2-trimethoxy-3-silylpropyl)pentan-2-imine has a molecular weight of 261.44 g/mol, XLogP of 1.24, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(1,1,2-trimethoxy-3-silylpropyl)pentan-2-imine is sourced from PubChem (CID 174942235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).