1-N-(3-trimethoxysilylpropyl)butane-1,2,3-triamine

C10H27N3O3Si — CID 175223273

IUPAC1-N-(3-trimethoxysilylpropyl)butane-1,2,3-triamine
SMILESCO[Si](CCCNCC(N)C(C)N)(OC)OC
InChIInChI=1S/C10H27N3O3Si/c1-9(11)10(12)8-13-6-5-7-17(14-2,15-3)16-4/h9-10,13H,5-8,11-12H2,1-4H3
InChIKeyOTVFETFXJIOYEI-UHFFFAOYSA-N
MW265.43 g/mol
LogP-0.48
Rot. Bonds10

About 1-N-(3-trimethoxysilylpropyl)butane-1,2,3-triamine

1-N-(3-trimethoxysilylpropyl)butane-1,2,3-triamine (PubChem CID 175223273) has the molecular formula C10H27N3O3Si and a molecular weight of 265.43 g/mol. Its IUPAC name is 1-N-(3-trimethoxysilylpropyl)butane-1,2,3-triamine.

Molecular Properties

Compound Name1-N-(3-trimethoxysilylpropyl)butane-1,2,3-triamine
PubChem CID175223273
Molecular FormulaC10H27N3O3Si
Molecular Weight265.43 g/mol
Exact Mass265.18
IUPAC Name1-N-(3-trimethoxysilylpropyl)butane-1,2,3-triamine
SMILESCO[Si](CCCNCC(N)C(C)N)(OC)OC
InChIInChI=1S/C10H27N3O3Si/c1-9(11)10(12)8-13-6-5-7-17(14-2,15-3)16-4/h9-10,13H,5-8,11-12H2,1-4H3
InChIKeyOTVFETFXJIOYEI-UHFFFAOYSA-N
XLogP-0.48
TPSA91.76 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.43
LogP ≤ 5-0.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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'-(3-trimethoxysilylpropyl)methanediamine
CID 22721317
N'-[2-(3-trimethoxysilylpropylamino)ethyl]ethane-1,2-diamine
CID 159586592
molecular hydrogen;3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine
CID 160982698
N'-[2-(4-trimethoxysilylbutoxy)propyl]-N-(3-trimethoxysilylpropyl)ethane-1,2-diamine
CID 20618096
N'-(3-trimethoxysilylpropyl)hexane-1,6-diamine
CID 157123454
3-[diethoxy(methoxy)silyl]-N-[3-[diethoxy(methoxy)silyl]propyl]-2-methylpropan-1-amine
CID 87149014
3-propan-2-yloxy-N-(3-trimethoxysilylpropyl)propan-1-amine
CID 142737750
1-(3-trimethoxysilylpropoxy)-2-(3-trimethoxysilylpropylamino)ethanol
CID 20591048
3-N-methyl-1-N-(3-trimethoxysilylpropyl)butane-1,3-diamine
CID 172810414
18-methyl-N-(3-trimethoxysilylpropyl)nonadecan-1-amine;hydrochloride
CID 175425921
1,8-bis(trimethoxysilyl)octane-4,5-diamine
CID 57029504
1-N-[3-[dimethoxy(methyl)silyl]propyl]butane-1,2,4-triamine
CID 141486440

Frequently Asked Questions

What is the IUPAC name of 1-N-(3-trimethoxysilylpropyl)butane-1,2,3-triamine?
The IUPAC name of 1-N-(3-trimethoxysilylpropyl)butane-1,2,3-triamine (CID 175223273) is 1-N-(3-trimethoxysilylpropyl)butane-1,2,3-triamine.
What is the SMILES notation for 1-N-(3-trimethoxysilylpropyl)butane-1,2,3-triamine?
The canonical SMILES for 1-N-(3-trimethoxysilylpropyl)butane-1,2,3-triamine is CO[Si](CCCNCC(N)C(C)N)(OC)OC.
What is the InChIKey of 1-N-(3-trimethoxysilylpropyl)butane-1,2,3-triamine?
The InChIKey is OTVFETFXJIOYEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H27N3O3Si/c1-9(11)10(12)8-13-6-5-7-17(14-2,15-3)16-4/h9-10,13H,5-8,11-12H2,1-4H3.
What are the key properties of 1-N-(3-trimethoxysilylpropyl)butane-1,2,3-triamine?
1-N-(3-trimethoxysilylpropyl)butane-1,2,3-triamine has a molecular weight of 265.43 g/mol, XLogP of -0.48, 10 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(3-trimethoxysilylpropyl)butane-1,2,3-triamine is sourced from PubChem (CID 175223273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).