2-(dimethylamino)-2-methoxy-2-(methylamino)acetic acid

C6H14N2O3 — CID 154443929

IUPAC2-(dimethylamino)-2-methoxy-2-(methylamino)acetic acid
SMILESCNC(OC)(C(=O)O)N(C)C
InChIInChI=1S/C6H14N2O3/c1-7-6(11-4,5(9)10)8(2)3/h7H,1-4H3,(H,9,10)
InChIKeyMZCPGFYZFMZNBX-UHFFFAOYSA-N
MW162.19 g/mol
LogP-0.85
Rot. Bonds4

About 2-(dimethylamino)-2-methoxy-2-(methylamino)acetic acid

2-(dimethylamino)-2-methoxy-2-(methylamino)acetic acid (PubChem CID 154443929) has the molecular formula C6H14N2O3 and a molecular weight of 162.19 g/mol. Its IUPAC name is 2-(dimethylamino)-2-methoxy-2-(methylamino)acetic acid.

Molecular Properties

Compound Name2-(dimethylamino)-2-methoxy-2-(methylamino)acetic acid
PubChem CID154443929
Molecular FormulaC6H14N2O3
Molecular Weight162.19 g/mol
Exact Mass162.10
IUPAC Name2-(dimethylamino)-2-methoxy-2-(methylamino)acetic acid
SMILESCNC(OC)(C(=O)O)N(C)C
InChIInChI=1S/C6H14N2O3/c1-7-6(11-4,5(9)10)8(2)3/h7H,1-4H3,(H,9,10)
InChIKeyMZCPGFYZFMZNBX-UHFFFAOYSA-N
XLogP-0.85
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 5-0.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

methyl 3-hydroxy-2-methyl-2-(methylamino)propanoate
CID 126976728
(2R)-2-methoxy-2-(methylamino)-3-oxopropanoic acid
CID 87241640
methoxymethanetricarboxylic acid
CID 18424768
methyl 2-methyl-2-((111C)methylamino)propanoate
CID 10534687
bis(2-amino-2-methylpropanoic acid);methyl 2-amino-2-methylpropanoate;2-methyl-2-(methylamino)propanoic acid
CID 158876988
3-methoxy-2,2-dimethyl-3-oxopropanoic acid;hydrochloride
CID 88675587
N-methoxymethanamine;2,2,2-trifluoroacetic acid
CID 86135706
methyl 2,4,4-trimethyl-2-(methylamino)pentanoate
CID 134267857
4-methoxy-2,4-dimethyl-2-methylsulfanylpentanoic acid
CID 114989365
dimethyl 2,3-dimethoxy-2,3-dimethylbutanedioate
CID 151999350
methyl hydrogen carbonate;2,2,2-trifluoroacetic acid
CID 158638631
4-[3-methoxypropyl(methyl)amino]-2-methyl-2-(methylamino)butanoic acid
CID 63009891

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-2-methoxy-2-(methylamino)acetic acid?
The IUPAC name of 2-(dimethylamino)-2-methoxy-2-(methylamino)acetic acid (CID 154443929) is 2-(dimethylamino)-2-methoxy-2-(methylamino)acetic acid.
What is the SMILES notation for 2-(dimethylamino)-2-methoxy-2-(methylamino)acetic acid?
The canonical SMILES for 2-(dimethylamino)-2-methoxy-2-(methylamino)acetic acid is CNC(OC)(C(=O)O)N(C)C.
What is the InChIKey of 2-(dimethylamino)-2-methoxy-2-(methylamino)acetic acid?
The InChIKey is MZCPGFYZFMZNBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O3/c1-7-6(11-4,5(9)10)8(2)3/h7H,1-4H3,(H,9,10).
What are the key properties of 2-(dimethylamino)-2-methoxy-2-(methylamino)acetic acid?
2-(dimethylamino)-2-methoxy-2-(methylamino)acetic acid has a molecular weight of 162.19 g/mol, XLogP of -0.85, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-2-methoxy-2-(methylamino)acetic acid is sourced from PubChem (CID 154443929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).