hydron;2-(methylamino)acetic acid;chloride

C3H8ClNO2 — CID 74764750

IUPAChydron;2-(methylamino)acetic acid;chloride
SMILESCNCC(=O)O.[Cl-].[H+]
InChIInChI=1S/C3H7NO2.ClH/c1-4-2-3(5)6;/h4H,2H2,1H3,(H,5,6);1H
InChIKeyWVKIFIROCHIWAY-UHFFFAOYSA-N
MW125.55 g/mol
LogP-3.59
Rot. Bonds2

About hydron;2-(methylamino)acetic acid;chloride

hydron;2-(methylamino)acetic acid;chloride (PubChem CID 74764750) has the molecular formula C3H8ClNO2 and a molecular weight of 125.55 g/mol. Its IUPAC name is hydron;2-(methylamino)acetic acid;chloride.

Molecular Properties

Compound Namehydron;2-(methylamino)acetic acid;chloride
PubChem CID74764750
Molecular FormulaC3H8ClNO2
Molecular Weight125.55 g/mol
Exact Mass125.02
IUPAC Namehydron;2-(methylamino)acetic acid;chloride
SMILESCNCC(=O)O.[Cl-].[H+]
InChIInChI=1S/C3H7NO2.ClH/c1-4-2-3(5)6;/h4H,2H2,1H3,(H,5,6);1H
InChIKeyWVKIFIROCHIWAY-UHFFFAOYSA-N
XLogP-3.59
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.55
LogP ≤ 5-3.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of hydron;2-(methylamino)acetic acid;chloride?
The IUPAC name of hydron;2-(methylamino)acetic acid;chloride (CID 74764750) is hydron;2-(methylamino)acetic acid;chloride.
What is the SMILES notation for hydron;2-(methylamino)acetic acid;chloride?
The canonical SMILES for hydron;2-(methylamino)acetic acid;chloride is CNCC(=O)O.[Cl-].[H+].
What is the InChIKey of hydron;2-(methylamino)acetic acid;chloride?
The InChIKey is WVKIFIROCHIWAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7NO2.ClH/c1-4-2-3(5)6;/h4H,2H2,1H3,(H,5,6);1H.
What are the key properties of hydron;2-(methylamino)acetic acid;chloride?
hydron;2-(methylamino)acetic acid;chloride has a molecular weight of 125.55 g/mol, XLogP of -3.59, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;2-(methylamino)acetic acid;chloride is sourced from PubChem (CID 74764750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).