2-(methylamino)-3-trimethylsilylpropanoic acid

C7H17NO2Si — CID 175259884

IUPAC2-(methylamino)-3-trimethylsilylpropanoic acid
SMILESCNC(C[Si](C)(C)C)C(=O)O
InChIInChI=1S/C7H17NO2Si/c1-8-6(7(9)10)5-11(2,3)4/h6,8H,5H2,1-4H3,(H,9,10)
InChIKeyPXKMQLYUNAELLM-UHFFFAOYSA-N
MW175.30 g/mol
LogP1.00
Rot. Bonds4

About 2-(methylamino)-3-trimethylsilylpropanoic acid

2-(methylamino)-3-trimethylsilylpropanoic acid (PubChem CID 175259884) has the molecular formula C7H17NO2Si and a molecular weight of 175.30 g/mol. Its IUPAC name is 2-(methylamino)-3-trimethylsilylpropanoic acid.

Molecular Properties

Compound Name2-(methylamino)-3-trimethylsilylpropanoic acid
PubChem CID175259884
Molecular FormulaC7H17NO2Si
Molecular Weight175.30 g/mol
Exact Mass175.10
IUPAC Name2-(methylamino)-3-trimethylsilylpropanoic acid
SMILESCNC(C[Si](C)(C)C)C(=O)O
InChIInChI=1S/C7H17NO2Si/c1-8-6(7(9)10)5-11(2,3)4/h6,8H,5H2,1-4H3,(H,9,10)
InChIKeyPXKMQLYUNAELLM-UHFFFAOYSA-N
XLogP1.00
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.30
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethane;2-(methylamino)butanoic acid
CID 91558033
3-chloro-2-(methylamino)propanoic acid;hydrochloride
CID 88507294
(2R)-2-(methylamino)pentanoic acid
CID 15677248
(2R)-2-(methylamino)-3-methylsulfanylpropanoic acid
CID 5288874
2,5-bis(methylamino)hexanediamide
CID 66221520
ethene;2-(methylamino)butanedioic acid
CID 174781740
(2S)-3-(3-hydroxyoxiran-2-yl)-2-(methylamino)propanoic acid
CID 174267692
3-ethylsulfonyl-2-(methylamino)propanoic acid
CID 83986201
6-methyl-2-(methylamino)heptanoic acid
CID 91290146
(2R,4S)-4-methyl-2-(methylamino)hexanoic acid
CID 59874884
(2S)-2-(methylamino)pentanoic acid;molecular hydrogen;propane
CID 169240700
5-amino-2-(methylamino)hexanoic acid
CID 139342913

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-3-trimethylsilylpropanoic acid?
The IUPAC name of 2-(methylamino)-3-trimethylsilylpropanoic acid (CID 175259884) is 2-(methylamino)-3-trimethylsilylpropanoic acid.
What is the SMILES notation for 2-(methylamino)-3-trimethylsilylpropanoic acid?
The canonical SMILES for 2-(methylamino)-3-trimethylsilylpropanoic acid is CNC(C[Si](C)(C)C)C(=O)O.
What is the InChIKey of 2-(methylamino)-3-trimethylsilylpropanoic acid?
The InChIKey is PXKMQLYUNAELLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO2Si/c1-8-6(7(9)10)5-11(2,3)4/h6,8H,5H2,1-4H3,(H,9,10).
What are the key properties of 2-(methylamino)-3-trimethylsilylpropanoic acid?
2-(methylamino)-3-trimethylsilylpropanoic acid has a molecular weight of 175.30 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-3-trimethylsilylpropanoic acid is sourced from PubChem (CID 175259884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).