molecular hydrogen;3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine

C12H33NO6Si2 — CID 160982698

IUPACmolecular hydrogen;3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine
SMILESCO[Si](CCCNCCC[Si](OC)(OC)OC)(OC)OC.[H][H]
InChIInChI=1S/C12H31NO6Si2.H2/c1-14-20(15-2,16-3)11-7-9-13-10-8-12-21(17-4,18-5)19-6;/h13H,7-12H2,1-6H3;1H
InChIKeySZSIZAWTJSMWHK-UHFFFAOYSA-N
MW343.57 g/mol
LogP1.36
Rot. Bonds14

About molecular hydrogen;3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine

molecular hydrogen;3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine (PubChem CID 160982698) has the molecular formula C12H33NO6Si2 and a molecular weight of 343.57 g/mol. Its IUPAC name is molecular hydrogen;3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine.

Molecular Properties

Compound Namemolecular hydrogen;3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine
PubChem CID160982698
Molecular FormulaC12H33NO6Si2
Molecular Weight343.57 g/mol
Exact Mass343.18
IUPAC Namemolecular hydrogen;3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine
SMILESCO[Si](CCCNCCC[Si](OC)(OC)OC)(OC)OC.[H][H]
InChIInChI=1S/C12H31NO6Si2.H2/c1-14-20(15-2,16-3)11-7-9-13-10-8-12-21(17-4,18-5)19-6;/h13H,7-12H2,1-6H3;1H
InChIKeySZSIZAWTJSMWHK-UHFFFAOYSA-N
XLogP1.36
TPSA67.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds14
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.57
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(3-trimethoxysilylpropylamino)ethyl]ethane-1,2-diamine
CID 159586592
N-methyl-N'-[2-[2-(3-trimethoxysilylpropylamino)ethylamino]ethyl]ethane-1,2-diamine
CID 134961256
N'-(3-trimethoxysilylpropyl)methanediamine
CID 22721317
4-methoxy-N-(3-trimethoxysilylpropyl)butan-1-amine
CID 142739557
N'-(3-trimethoxysilylpropyl)hexane-1,6-diamine
CID 157123454
3-[[dimethoxy-[3-(propylamino)propyl]silyl]oxy-dimethoxysilyl]-N-propylpropan-1-amine
CID 171623611
N'-(8-trimethoxysilyloctyl)ethane-1,2-diamine
CID 132554515
N-[3-[dimethoxy(methyl)silyl]propyl]-6-trimethoxysilylhexan-1-amine
CID 175874153
CID 153282899
CID 153282899
N-[3-[[3-(butylamino)propyl-[3-(butylamino)propyl-[3-(butylamino)propyl-dimethoxysilyl]oxy-methoxysilyl]oxy-methoxysilyl]oxy-dimethoxysilyl]propyl]butan-1-amine
CID 171623472
propan-2-one;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine
CID 175097855
N'-(2-aminoethyl)ethane-1,2-diamine;3-trimethoxysilylpropan-1-amine
CID 158654505

Frequently Asked Questions

What is the IUPAC name of molecular hydrogen;3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine?
The IUPAC name of molecular hydrogen;3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine (CID 160982698) is molecular hydrogen;3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine.
What is the SMILES notation for molecular hydrogen;3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine?
The canonical SMILES for molecular hydrogen;3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine is CO[Si](CCCNCCC[Si](OC)(OC)OC)(OC)OC.[H][H].
What is the InChIKey of molecular hydrogen;3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine?
The InChIKey is SZSIZAWTJSMWHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H31NO6Si2.H2/c1-14-20(15-2,16-3)11-7-9-13-10-8-12-21(17-4,18-5)19-6;/h13H,7-12H2,1-6H3;1H.
What are the key properties of molecular hydrogen;3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine?
molecular hydrogen;3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine has a molecular weight of 343.57 g/mol, XLogP of 1.36, 14 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for molecular hydrogen;3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine is sourced from PubChem (CID 160982698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).