[1-(dimethylamino)-5-triethoxysilylpentan-3-yl] carbamate

C14H32N2O5Si — CID 87369705

IUPAC[1-(dimethylamino)-5-triethoxysilylpentan-3-yl] carbamate
SMILESCCO[Si](CCC(CCN(C)C)OC(N)=O)(OCC)OCC
InChIInChI=1S/C14H32N2O5Si/c1-6-18-22(19-7-2,20-8-3)12-10-13(21-14(15)17)9-11-16(4)5/h13H,6-12H2,1-5H3,(H2,15,17)
InChIKeyUPSDIOLEZZIUJC-UHFFFAOYSA-N
MW336.51 g/mol
LogP1.84
Rot. Bonds13

About [1-(dimethylamino)-5-triethoxysilylpentan-3-yl] carbamate

[1-(dimethylamino)-5-triethoxysilylpentan-3-yl] carbamate (PubChem CID 87369705) has the molecular formula C14H32N2O5Si and a molecular weight of 336.51 g/mol. Its IUPAC name is [1-(dimethylamino)-5-triethoxysilylpentan-3-yl] carbamate.

Molecular Properties

Compound Name[1-(dimethylamino)-5-triethoxysilylpentan-3-yl] carbamate
PubChem CID87369705
Molecular FormulaC14H32N2O5Si
Molecular Weight336.51 g/mol
Exact Mass336.21
IUPAC Name[1-(dimethylamino)-5-triethoxysilylpentan-3-yl] carbamate
SMILESCCO[Si](CCC(CCN(C)C)OC(N)=O)(OCC)OCC
InChIInChI=1S/C14H32N2O5Si/c1-6-18-22(19-7-2,20-8-3)12-10-13(21-14(15)17)9-11-16(4)5/h13H,6-12H2,1-5H3,(H2,15,17)
InChIKeyUPSDIOLEZZIUJC-UHFFFAOYSA-N
XLogP1.84
TPSA83.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.51
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze [1-(dimethylamino)-5-triethoxysilylpentan-3-yl] carbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-(dimethylamino)-2-(triethoxysilylmethyl)butyl] carbamate
CID 87369702
[2-(dimethylamino)-1-triethoxysilylpentan-3-yl] carbamate
CID 175246866
carbamic acid;triethoxy(propyl)silane
CID 175441799
1,3-bis(triethoxysilyl)propan-1-amine
CID 154111466
(2-hydroxy-6-triethoxysilylhexyl) carbamate
CID 154262289
ethyl carbamate;3-triethoxysilylpropan-1-amine
CID 90205560
1-(2-aminoethyl)-1-(3-triethoxysilylpropyl)urea
CID 123366285
2-[diethoxy(methoxy)silyl]-N,N-dimethylethanamine
CID 155655045
triethylsilyl 2-methyl-3-[methyl(3-triethoxysilylpropyl)amino]propanoate
CID 88852119
ethyl 4-(dimethylamino)-2-(ethylamino)butanoate
CID 63028800
1-(dimethylamino)pentan-3-yl butanoate
CID 177025581
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 [1-(dimethylamino)-5-triethoxysilylpentan-3-yl] carbamate?
The IUPAC name of [1-(dimethylamino)-5-triethoxysilylpentan-3-yl] carbamate (CID 87369705) is [1-(dimethylamino)-5-triethoxysilylpentan-3-yl] carbamate.
What is the SMILES notation for [1-(dimethylamino)-5-triethoxysilylpentan-3-yl] carbamate?
The canonical SMILES for [1-(dimethylamino)-5-triethoxysilylpentan-3-yl] carbamate is CCO[Si](CCC(CCN(C)C)OC(N)=O)(OCC)OCC.
What is the InChIKey of [1-(dimethylamino)-5-triethoxysilylpentan-3-yl] carbamate?
The InChIKey is UPSDIOLEZZIUJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32N2O5Si/c1-6-18-22(19-7-2,20-8-3)12-10-13(21-14(15)17)9-11-16(4)5/h13H,6-12H2,1-5H3,(H2,15,17).
What are the key properties of [1-(dimethylamino)-5-triethoxysilylpentan-3-yl] carbamate?
[1-(dimethylamino)-5-triethoxysilylpentan-3-yl] carbamate has a molecular weight of 336.51 g/mol, XLogP of 1.84, 13 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(dimethylamino)-5-triethoxysilylpentan-3-yl] carbamate is sourced from PubChem (CID 87369705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).