2-[methyl(methylamino)amino]acetic acid

C4H10N2O2 — CID 87884625

IUPAC2-[methyl(methylamino)amino]acetic acid
SMILESCNN(C)CC(=O)O
InChIInChI=1S/C4H10N2O2/c1-5-6(2)3-4(7)8/h5H,3H2,1-2H3,(H,7,8)
InChIKeyLUFIQNLBTSXCJW-UHFFFAOYSA-N
MW118.14 g/mol
LogP-0.86
Rot. Bonds3

About 2-[methyl(methylamino)amino]acetic acid

2-[methyl(methylamino)amino]acetic acid (PubChem CID 87884625) has the molecular formula C4H10N2O2 and a molecular weight of 118.14 g/mol. Its IUPAC name is 2-[methyl(methylamino)amino]acetic acid.

Molecular Properties

Compound Name2-[methyl(methylamino)amino]acetic acid
PubChem CID87884625
Molecular FormulaC4H10N2O2
Molecular Weight118.14 g/mol
Exact Mass118.07
IUPAC Name2-[methyl(methylamino)amino]acetic acid
SMILESCNN(C)CC(=O)O
InChIInChI=1S/C4H10N2O2/c1-5-6(2)3-4(7)8/h5H,3H2,1-2H3,(H,7,8)
InChIKeyLUFIQNLBTSXCJW-UHFFFAOYSA-N
XLogP-0.86
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.14
LogP ≤ 5-0.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[methyl(methylamino)amino]acetic acid?
The IUPAC name of 2-[methyl(methylamino)amino]acetic acid (CID 87884625) is 2-[methyl(methylamino)amino]acetic acid.
What is the SMILES notation for 2-[methyl(methylamino)amino]acetic acid?
The canonical SMILES for 2-[methyl(methylamino)amino]acetic acid is CNN(C)CC(=O)O.
What is the InChIKey of 2-[methyl(methylamino)amino]acetic acid?
The InChIKey is LUFIQNLBTSXCJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2O2/c1-5-6(2)3-4(7)8/h5H,3H2,1-2H3,(H,7,8).
What are the key properties of 2-[methyl(methylamino)amino]acetic acid?
2-[methyl(methylamino)amino]acetic acid has a molecular weight of 118.14 g/mol, XLogP of -0.86, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(methylamino)amino]acetic acid is sourced from PubChem (CID 87884625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).