3-carboxypropyl-dimethyl-(trimethylsilylmethyl)azanium

C10H24NO2Si+ — CID 3836027

IUPAC3-carboxypropyl-dimethyl-(trimethylsilylmethyl)azanium
SMILESC[N+](C)(CCCC(=O)O)C[Si](C)(C)C
InChIInChI=1S/C10H23NO2Si/c1-11(2,9-14(3,4)5)8-6-7-10(12)13/h6-9H2,1-5H3/p+1
InChIKeyNWLATGCSRKWHLS-UHFFFAOYSA-O
MW218.39 g/mol
LogP1.80
Rot. Bonds6

About 3-carboxypropyl-dimethyl-(trimethylsilylmethyl)azanium

3-carboxypropyl-dimethyl-(trimethylsilylmethyl)azanium (PubChem CID 3836027) has the molecular formula C10H24NO2Si+ and a molecular weight of 218.39 g/mol. Its IUPAC name is 3-carboxypropyl-dimethyl-(trimethylsilylmethyl)azanium.

Molecular Properties

Compound Name3-carboxypropyl-dimethyl-(trimethylsilylmethyl)azanium
PubChem CID3836027
Molecular FormulaC10H24NO2Si+
Molecular Weight218.39 g/mol
Exact Mass218.16
IUPAC Name3-carboxypropyl-dimethyl-(trimethylsilylmethyl)azanium
SMILESC[N+](C)(CCCC(=O)O)C[Si](C)(C)C
InChIInChI=1S/C10H23NO2Si/c1-11(2,9-14(3,4)5)8-6-7-10(12)13/h6-9H2,1-5H3/p+1
InChIKeyNWLATGCSRKWHLS-UHFFFAOYSA-O
XLogP1.80
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.39
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

5-[dimethyl(trimethylsilylmethyl)azaniumyl]pentanoate;hydrobromide
CID 131665369
3-carboxypropyl-(chloromethyl)-dimethylazanium
CID 66575660
butanedioic acid;3-carboxypropyl-ethyl-dimethylazanium
CID 71466365
bis(11-carboxyundecyl)-dimethylazanium
CID 102174919
3-carboxypropyl-dimethyl-octadecylazanium
CID 11596115
benzyl-(3-carboxypropyl)-dimethylazanium
CID 90655213
5-carboxypentyl-icosyl-dimethylazanium bromide
CID 88762606
3-carboxypropyl-dimethyl-[6-(prop-2-enoylamino)hexyl]azanium
CID 118143398
6-carboxyhexyl(trimethyl)azanium
CID 70691026
5-carboxypentyl-(2-methoxyethyl)-dimethylazanium;hydrochloride
CID 161408438
4-carboxybutyl-dimethyl-[2-(prop-2-enoylamino)ethyl]azanium
CID 172711570
3-carboxypropyl-methyl-bis(prop-2-enyl)azanium
CID 87275045

Frequently Asked Questions

What is the IUPAC name of 3-carboxypropyl-dimethyl-(trimethylsilylmethyl)azanium?
The IUPAC name of 3-carboxypropyl-dimethyl-(trimethylsilylmethyl)azanium (CID 3836027) is 3-carboxypropyl-dimethyl-(trimethylsilylmethyl)azanium.
What is the SMILES notation for 3-carboxypropyl-dimethyl-(trimethylsilylmethyl)azanium?
The canonical SMILES for 3-carboxypropyl-dimethyl-(trimethylsilylmethyl)azanium is C[N+](C)(CCCC(=O)O)C[Si](C)(C)C.
What is the InChIKey of 3-carboxypropyl-dimethyl-(trimethylsilylmethyl)azanium?
The InChIKey is NWLATGCSRKWHLS-UHFFFAOYSA-O. The full InChI is InChI=1S/C10H23NO2Si/c1-11(2,9-14(3,4)5)8-6-7-10(12)13/h6-9H2,1-5H3/p+1.
What are the key properties of 3-carboxypropyl-dimethyl-(trimethylsilylmethyl)azanium?
3-carboxypropyl-dimethyl-(trimethylsilylmethyl)azanium has a molecular weight of 218.39 g/mol, XLogP of 1.80, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-carboxypropyl-dimethyl-(trimethylsilylmethyl)azanium is sourced from PubChem (CID 3836027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).