4-[diethoxy(methyl)silyl]oxy-1-N,1-N-dimethylpentane-1,4-diamine

C12H30N2O3Si — CID 160890336

IUPAC4-[diethoxy(methyl)silyl]oxy-1-N,1-N-dimethylpentane-1,4-diamine
SMILESCCO[Si](C)(OCC)OC(C)(N)CCCN(C)C
InChIInChI=1S/C12H30N2O3Si/c1-7-15-18(6,16-8-2)17-12(3,13)10-9-11-14(4)5/h7-11,13H2,1-6H3
InChIKeySOEKVBCTZPLESZ-UHFFFAOYSA-N
MW278.47 g/mol
LogP1.66
Rot. Bonds10

About 4-[diethoxy(methyl)silyl]oxy-1-N,1-N-dimethylpentane-1,4-diamine

4-[diethoxy(methyl)silyl]oxy-1-N,1-N-dimethylpentane-1,4-diamine (PubChem CID 160890336) has the molecular formula C12H30N2O3Si and a molecular weight of 278.47 g/mol. Its IUPAC name is 4-[diethoxy(methyl)silyl]oxy-1-N,1-N-dimethylpentane-1,4-diamine.

Molecular Properties

Compound Name4-[diethoxy(methyl)silyl]oxy-1-N,1-N-dimethylpentane-1,4-diamine
PubChem CID160890336
Molecular FormulaC12H30N2O3Si
Molecular Weight278.47 g/mol
Exact Mass278.20
IUPAC Name4-[diethoxy(methyl)silyl]oxy-1-N,1-N-dimethylpentane-1,4-diamine
SMILESCCO[Si](C)(OCC)OC(C)(N)CCCN(C)C
InChIInChI=1S/C12H30N2O3Si/c1-7-15-18(6,16-8-2)17-12(3,13)10-9-11-14(4)5/h7-11,13H2,1-6H3
InChIKeySOEKVBCTZPLESZ-UHFFFAOYSA-N
XLogP1.66
TPSA56.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.47
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-[3-(dimethylamino)propyl]-4-[[ethoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetramethylheptane-1,7-diamine
CID 140647381
5-[diethoxy(methyl)silyl]oxydecan-5-amine
CID 163643543
4-[[diethoxy(ethyl)silyl]methyl]-4-[3-(dimethylamino)propyl]-N,N,N',N'-tetramethylheptane-1,7-diamine
CID 140647270
4-[3-(dimethylamino)propyl]-4-[[ethoxy(diethyl)silyl]methyl]-N,N,N',N'-tetramethylheptane-1,7-diamine
CID 140647576
3-[[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-ethoxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-ethoxy-methylsilyl]-N,N-dimethylpropan-1-amine
CID 171623500
triethoxy(methyl)silane
CID 16241
4-chloro-N,N,4-trimethylpentan-1-amine
CID 2780460
6-(dimethylamino)-3-methylhexan-3-ol
CID 12542595
triethoxy(methyl)silane;hydrate
CID 159569985
ethyl 2-amino-4-[3-(dimethylamino)propyl-methylamino]-2-methylbutanoate
CID 63700322
ethane-1,2-diamine;triethoxy(methyl)silane
CID 158658037
N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-(3-triethoxysilylpropyl)propane-1,3-diamine
CID 140647406

Frequently Asked Questions

What is the IUPAC name of 4-[diethoxy(methyl)silyl]oxy-1-N,1-N-dimethylpentane-1,4-diamine?
The IUPAC name of 4-[diethoxy(methyl)silyl]oxy-1-N,1-N-dimethylpentane-1,4-diamine (CID 160890336) is 4-[diethoxy(methyl)silyl]oxy-1-N,1-N-dimethylpentane-1,4-diamine.
What is the SMILES notation for 4-[diethoxy(methyl)silyl]oxy-1-N,1-N-dimethylpentane-1,4-diamine?
The canonical SMILES for 4-[diethoxy(methyl)silyl]oxy-1-N,1-N-dimethylpentane-1,4-diamine is CCO[Si](C)(OCC)OC(C)(N)CCCN(C)C.
What is the InChIKey of 4-[diethoxy(methyl)silyl]oxy-1-N,1-N-dimethylpentane-1,4-diamine?
The InChIKey is SOEKVBCTZPLESZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H30N2O3Si/c1-7-15-18(6,16-8-2)17-12(3,13)10-9-11-14(4)5/h7-11,13H2,1-6H3.
What are the key properties of 4-[diethoxy(methyl)silyl]oxy-1-N,1-N-dimethylpentane-1,4-diamine?
4-[diethoxy(methyl)silyl]oxy-1-N,1-N-dimethylpentane-1,4-diamine has a molecular weight of 278.47 g/mol, XLogP of 1.66, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[diethoxy(methyl)silyl]oxy-1-N,1-N-dimethylpentane-1,4-diamine is sourced from PubChem (CID 160890336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).