propyl N-trimethoxysilylcarbamate

C7H17NO5Si — CID 91603083

IUPACpropyl N-trimethoxysilylcarbamate
SMILESCCCOC(=O)N[Si](OC)(OC)OC
InChIInChI=1S/C7H17NO5Si/c1-5-6-13-7(9)8-14(10-2,11-3)12-4/h5-6H2,1-4H3,(H,8,9)
InChIKeyZQMNJQFEMTXJCQ-UHFFFAOYSA-N
MW223.30 g/mol
LogP0.50
Rot. Bonds6

About propyl N-trimethoxysilylcarbamate

propyl N-trimethoxysilylcarbamate (PubChem CID 91603083) has the molecular formula C7H17NO5Si and a molecular weight of 223.30 g/mol. Its IUPAC name is propyl N-trimethoxysilylcarbamate.

Molecular Properties

Compound Namepropyl N-trimethoxysilylcarbamate
PubChem CID91603083
Molecular FormulaC7H17NO5Si
Molecular Weight223.30 g/mol
Exact Mass223.09
IUPAC Namepropyl N-trimethoxysilylcarbamate
SMILESCCCOC(=O)N[Si](OC)(OC)OC
InChIInChI=1S/C7H17NO5Si/c1-5-6-13-7(9)8-14(10-2,11-3)12-4/h5-6H2,1-4H3,(H,8,9)
InChIKeyZQMNJQFEMTXJCQ-UHFFFAOYSA-N
XLogP0.50
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.30
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze propyl N-trimethoxysilylcarbamate 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

ethane;propyl N-methylcarbamate
CID 142560404
butane;propyl N-hydroxycarbamate
CID 174767978
propyl N-(methoxymethyl)carbamate
CID 142704391
propyl 2-(2-methoxyethoxycarbonylamino)acetate
CID 91693785
ethyl 2-(propoxycarbonylamino)acetate
CID 6422290
propyl N-(dihydroxymethyl)carbamate
CID 174469306
propyl 4-trimethoxysilylbutanoate
CID 174313237
propyl N-iodosulfonylcarbamate
CID 89299512
tripropyl cyclopropane-1,2,3-tricarboxylate
CID 177455130
magnesium propyl carbonate
CID 22154995
calcium propyl carbonate
CID 158672692
dimethyl pentanedioate;dipropyl butanedioate
CID 174797581

Frequently Asked Questions

What is the IUPAC name of propyl N-trimethoxysilylcarbamate?
The IUPAC name of propyl N-trimethoxysilylcarbamate (CID 91603083) is propyl N-trimethoxysilylcarbamate.
What is the SMILES notation for propyl N-trimethoxysilylcarbamate?
The canonical SMILES for propyl N-trimethoxysilylcarbamate is CCCOC(=O)N[Si](OC)(OC)OC.
What is the InChIKey of propyl N-trimethoxysilylcarbamate?
The InChIKey is ZQMNJQFEMTXJCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO5Si/c1-5-6-13-7(9)8-14(10-2,11-3)12-4/h5-6H2,1-4H3,(H,8,9).
What are the key properties of propyl N-trimethoxysilylcarbamate?
propyl N-trimethoxysilylcarbamate has a molecular weight of 223.30 g/mol, XLogP of 0.50, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for propyl N-trimethoxysilylcarbamate is sourced from PubChem (CID 91603083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).