2-N-(2-aminoethyl)-5-trimethoxysilylpentane-1,2-diamine

C10H27N3O3Si — CID 87271772

IUPAC2-N-(2-aminoethyl)-5-trimethoxysilylpentane-1,2-diamine
SMILESCO[Si](CCCC(CN)NCCN)(OC)OC
InChIInChI=1S/C10H27N3O3Si/c1-14-17(15-2,16-3)8-4-5-10(9-12)13-7-6-11/h10,13H,4-9,11-12H2,1-3H3
InChIKeyGHNFXFCVNHUNQY-UHFFFAOYSA-N
MW265.43 g/mol
LogP-0.48
Rot. Bonds11

About 2-N-(2-aminoethyl)-5-trimethoxysilylpentane-1,2-diamine

2-N-(2-aminoethyl)-5-trimethoxysilylpentane-1,2-diamine (PubChem CID 87271772) has the molecular formula C10H27N3O3Si and a molecular weight of 265.43 g/mol. Its IUPAC name is 2-N-(2-aminoethyl)-5-trimethoxysilylpentane-1,2-diamine.

Molecular Properties

Compound Name2-N-(2-aminoethyl)-5-trimethoxysilylpentane-1,2-diamine
PubChem CID87271772
Molecular FormulaC10H27N3O3Si
Molecular Weight265.43 g/mol
Exact Mass265.18
IUPAC Name2-N-(2-aminoethyl)-5-trimethoxysilylpentane-1,2-diamine
SMILESCO[Si](CCCC(CN)NCCN)(OC)OC
InChIInChI=1S/C10H27N3O3Si/c1-14-17(15-2,16-3)8-4-5-10(9-12)13-7-6-11/h10,13H,4-9,11-12H2,1-3H3
InChIKeyGHNFXFCVNHUNQY-UHFFFAOYSA-N
XLogP-0.48
TPSA91.76 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds11
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': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

N'-[2-(3-trimethoxysilylpropylamino)ethyl]ethane-1,2-diamine
CID 159586592
N'-(8-trimethoxysilyloctyl)ethane-1,2-diamine
CID 132554515
N'-(2-aminoethyl)ethane-1,2-diamine;3-trimethoxysilylpropan-1-amine
CID 158654505
4-amino-3-[3-[dimethoxy(methyl)silyl]propylamino]butan-1-ol
CID 87772764
2-N-(3-phenylprop-2-enyl)-5-trimethoxysilylpentane-1,2-diamine
CID 57057257
N'-(1-trimethoxysilylpropan-2-yl)ethane-1,2-diamine
CID 22661604
1,8-bis(trimethoxysilyl)octane-4,5-diamine
CID 57029504
propan-2-one;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine
CID 175097855
N'-(3-trimethoxysilylpropyl)methanediamine
CID 22721317
N'-heptan-3-ylethane-1,2-diamine
CID 63945337
N'-(3-trimethoxysilylpropyl)hexane-1,6-diamine
CID 157123454
N'-(6-trimethoxysilylhexyl)propane-1,3-diamine
CID 54277347

Frequently Asked Questions

What is the IUPAC name of 2-N-(2-aminoethyl)-5-trimethoxysilylpentane-1,2-diamine?
The IUPAC name of 2-N-(2-aminoethyl)-5-trimethoxysilylpentane-1,2-diamine (CID 87271772) is 2-N-(2-aminoethyl)-5-trimethoxysilylpentane-1,2-diamine.
What is the SMILES notation for 2-N-(2-aminoethyl)-5-trimethoxysilylpentane-1,2-diamine?
The canonical SMILES for 2-N-(2-aminoethyl)-5-trimethoxysilylpentane-1,2-diamine is CO[Si](CCCC(CN)NCCN)(OC)OC.
What is the InChIKey of 2-N-(2-aminoethyl)-5-trimethoxysilylpentane-1,2-diamine?
The InChIKey is GHNFXFCVNHUNQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H27N3O3Si/c1-14-17(15-2,16-3)8-4-5-10(9-12)13-7-6-11/h10,13H,4-9,11-12H2,1-3H3.
What are the key properties of 2-N-(2-aminoethyl)-5-trimethoxysilylpentane-1,2-diamine?
2-N-(2-aminoethyl)-5-trimethoxysilylpentane-1,2-diamine has a molecular weight of 265.43 g/mol, XLogP of -0.48, 11 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-aminoethyl)-5-trimethoxysilylpentane-1,2-diamine is sourced from PubChem (CID 87271772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).