N'-[2-[1-[dimethoxy(methyl)silyl]propylamino]ethyl]ethane-1,2-diamine

C10H27N3O2Si — CID 19801524

IUPACN'-[2-[1-[dimethoxy(methyl)silyl]propylamino]ethyl]ethane-1,2-diamine
SMILESCCC(NCCNCCN)[Si](C)(OC)OC
InChIInChI=1S/C10H27N3O2Si/c1-5-10(16(4,14-2)15-3)13-9-8-12-7-6-11/h10,12-13H,5-9,11H2,1-4H3
InChIKeyHKOONWKCFAWDSB-UHFFFAOYSA-N
MW249.43 g/mol
LogP-0.19
Rot. Bonds10

About N'-[2-[1-[dimethoxy(methyl)silyl]propylamino]ethyl]ethane-1,2-diamine

N'-[2-[1-[dimethoxy(methyl)silyl]propylamino]ethyl]ethane-1,2-diamine (PubChem CID 19801524) has the molecular formula C10H27N3O2Si and a molecular weight of 249.43 g/mol. Its IUPAC name is N'-[2-[1-[dimethoxy(methyl)silyl]propylamino]ethyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-[2-[1-[dimethoxy(methyl)silyl]propylamino]ethyl]ethane-1,2-diamine
PubChem CID19801524
Molecular FormulaC10H27N3O2Si
Molecular Weight249.43 g/mol
Exact Mass249.19
IUPAC NameN'-[2-[1-[dimethoxy(methyl)silyl]propylamino]ethyl]ethane-1,2-diamine
SMILESCCC(NCCNCCN)[Si](C)(OC)OC
InChIInChI=1S/C10H27N3O2Si/c1-5-10(16(4,14-2)15-3)13-9-8-12-7-6-11/h10,12-13H,5-9,11H2,1-4H3
InChIKeyHKOONWKCFAWDSB-UHFFFAOYSA-N
XLogP-0.19
TPSA68.54 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.43
LogP ≤ 5-0.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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-[dimethoxy(methyl)silyl]butyl]ethane-1,2-diamine
CID 20524577
N'-[2-[2-[2-[2-[2-(butan-2-ylamino)ethylamino]ethylamino]ethylamino]ethylamino]ethyl]ethane-1,2-diamine
CID 130342854
N'-[2-(3-trimethoxysilylpropylamino)ethyl]ethane-1,2-diamine
CID 159586592
N'-(2-aminoethyl)-3-trimethoxysilylhexane-1,6-diamine
CID 91312483
N'-[2-[2-[2-(propan-2-ylamino)ethylamino]ethylamino]ethyl]ethane-1,2-diamine
CID 87748300
1-N-(2-aminoethyl)-1-N'-[2-(2-aminoethylamino)ethyl]ethane-1,1-diamine
CID 18468827
N'-(2-aminoethyl)ethane-1,2-diamine;3-trimethoxysilylpropan-1-amine
CID 158654505
N-[1-[diethoxy(methyl)silyl]propyl]butan-1-amine
CID 175581846
N'-[2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]ethyl]ethane-1,2-diamine;N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine;N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;N'-(2-aminoethyl)ethane-1,2-diamine
CID 159410169
N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine
CID 5565
1-N-[1-[dimethoxy(methyl)silyl]propyl]-1-N',1-N'-dimethylpropane-1,1-diamine
CID 141254492
N'-(8-trimethoxysilyloctyl)ethane-1,2-diamine
CID 132554515

Frequently Asked Questions

What is the IUPAC name of N'-[2-[1-[dimethoxy(methyl)silyl]propylamino]ethyl]ethane-1,2-diamine?
The IUPAC name of N'-[2-[1-[dimethoxy(methyl)silyl]propylamino]ethyl]ethane-1,2-diamine (CID 19801524) is N'-[2-[1-[dimethoxy(methyl)silyl]propylamino]ethyl]ethane-1,2-diamine.
What is the SMILES notation for N'-[2-[1-[dimethoxy(methyl)silyl]propylamino]ethyl]ethane-1,2-diamine?
The canonical SMILES for N'-[2-[1-[dimethoxy(methyl)silyl]propylamino]ethyl]ethane-1,2-diamine is CCC(NCCNCCN)[Si](C)(OC)OC.
What is the InChIKey of N'-[2-[1-[dimethoxy(methyl)silyl]propylamino]ethyl]ethane-1,2-diamine?
The InChIKey is HKOONWKCFAWDSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H27N3O2Si/c1-5-10(16(4,14-2)15-3)13-9-8-12-7-6-11/h10,12-13H,5-9,11H2,1-4H3.
What are the key properties of N'-[2-[1-[dimethoxy(methyl)silyl]propylamino]ethyl]ethane-1,2-diamine?
N'-[2-[1-[dimethoxy(methyl)silyl]propylamino]ethyl]ethane-1,2-diamine has a molecular weight of 249.43 g/mol, XLogP of -0.19, 10 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-[1-[dimethoxy(methyl)silyl]propylamino]ethyl]ethane-1,2-diamine is sourced from PubChem (CID 19801524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).