3-[carbazol-9-yl(methyl)amino]propyl N-(2-triethoxysilylethyl)carbamate

C25H37N3O5Si — CID 102214393

IUPAC3-[carbazol-9-yl(methyl)amino]propyl N-(2-triethoxysilylethyl)carbamate
SMILESCCO[Si](CCNC(=O)OCCCN(C)n1c2ccccc2c2ccccc21)(OCC)OCC
InChIInChI=1S/C25H37N3O5Si/c1-5-31-34(32-6-2,33-7-3)20-17-26-25(29)30-19-12-18-27(4)28-23-15-10-8-13-21(23)22-14-9-11-16-24(22)28/h8-11,13-16H,5-7,12,17-20H2,1-4H3,(H,26,29)
InChIKeyKDKZSQNQNQLODT-UHFFFAOYSA-N
MW487.67 g/mol
LogP4.53
Rot. Bonds14

About 3-[carbazol-9-yl(methyl)amino]propyl N-(2-triethoxysilylethyl)carbamate

3-[carbazol-9-yl(methyl)amino]propyl N-(2-triethoxysilylethyl)carbamate (PubChem CID 102214393) has the molecular formula C25H37N3O5Si and a molecular weight of 487.67 g/mol. Its IUPAC name is 3-[carbazol-9-yl(methyl)amino]propyl N-(2-triethoxysilylethyl)carbamate.

Molecular Properties

Compound Name3-[carbazol-9-yl(methyl)amino]propyl N-(2-triethoxysilylethyl)carbamate
PubChem CID102214393
Molecular FormulaC25H37N3O5Si
Molecular Weight487.67 g/mol
Exact Mass487.25
IUPAC Name3-[carbazol-9-yl(methyl)amino]propyl N-(2-triethoxysilylethyl)carbamate
SMILESCCO[Si](CCNC(=O)OCCCN(C)n1c2ccccc2c2ccccc21)(OCC)OCC
InChIInChI=1S/C25H37N3O5Si/c1-5-31-34(32-6-2,33-7-3)20-17-26-25(29)30-19-12-18-27(4)28-23-15-10-8-13-21(23)22-14-9-11-16-24(22)28/h8-11,13-16H,5-7,12,17-20H2,1-4H3,(H,26,29)
InChIKeyKDKZSQNQNQLODT-UHFFFAOYSA-N
XLogP4.53
TPSA74.19 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds14
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500487.67
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze 3-[carbazol-9-yl(methyl)amino]propyl N-(2-triethoxysilylethyl)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

methyl (E)-3-[4-[6-(2-triethoxysilylethylcarbamoyloxy)hexoxy]naphthalen-1-yl]prop-2-enoate
CID 139766244
3-[3-(N-[3-[3-(3-triethoxysilylpropylcarbamoyloxy)propyl]phenyl]anilino)phenyl]propyl N-(3-triethoxysilylpropyl)carbamate
CID 21136797
(E)-3-[4-[3-(3-triethoxysilylpropylcarbamoyloxy)propoxy]naphthalen-1-yl]prop-2-enoic acid
CID 70128744
octadecyl N-(3-triethoxysilylpropyl)carbamate
CID 58802948
heptadecyl N-(3-triethoxysilylpropyl)carbamate
CID 102190904
[4-(N-phenylanilino)phenyl]methyl N-(3-triethoxysilylpropyl)carbamate
CID 20771518
2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl N-(3-triethoxysilylpropyl)carbamate
CID 102138334
[3-oxo-3-(3-triethoxysilylpropylamino)propyl] N-(3-triethoxysilylpropyl)carbamate
CID 123219063
6-(3-triethoxysilylpropylcarbamoyloxy)hexanoic acid
CID 58205270
N,N-dimethylaniline;4-(3-triethoxysilylpropylcarbamoyloxymethyl)benzoic acid
CID 175092573
[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]methyl N-(3-triethoxysilylpropyl)carbamate
CID 59065485
3-(diethylamino)propyl carbazole-9-carboxylate;hydrochloride
CID 138400906

Frequently Asked Questions

What is the IUPAC name of 3-[carbazol-9-yl(methyl)amino]propyl N-(2-triethoxysilylethyl)carbamate?
The IUPAC name of 3-[carbazol-9-yl(methyl)amino]propyl N-(2-triethoxysilylethyl)carbamate (CID 102214393) is 3-[carbazol-9-yl(methyl)amino]propyl N-(2-triethoxysilylethyl)carbamate.
What is the SMILES notation for 3-[carbazol-9-yl(methyl)amino]propyl N-(2-triethoxysilylethyl)carbamate?
The canonical SMILES for 3-[carbazol-9-yl(methyl)amino]propyl N-(2-triethoxysilylethyl)carbamate is CCO[Si](CCNC(=O)OCCCN(C)n1c2ccccc2c2ccccc21)(OCC)OCC.
What is the InChIKey of 3-[carbazol-9-yl(methyl)amino]propyl N-(2-triethoxysilylethyl)carbamate?
The InChIKey is KDKZSQNQNQLODT-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H37N3O5Si/c1-5-31-34(32-6-2,33-7-3)20-17-26-25(29)30-19-12-18-27(4)28-23-15-10-8-13-21(23)22-14-9-11-16-24(22)28/h8-11,13-16H,5-7,12,17-20H2,1-4H3,(H,26,29).
What are the key properties of 3-[carbazol-9-yl(methyl)amino]propyl N-(2-triethoxysilylethyl)carbamate?
3-[carbazol-9-yl(methyl)amino]propyl N-(2-triethoxysilylethyl)carbamate has a molecular weight of 487.67 g/mol, XLogP of 4.53, 14 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[carbazol-9-yl(methyl)amino]propyl N-(2-triethoxysilylethyl)carbamate is sourced from PubChem (CID 102214393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).