2-(dimethylamino)acetic acid

C4H9NO2 — CID 673

IUPAC2-(dimethylamino)acetic acid
SMILESCN(C)CC(=O)O
InChIInChI=1S/C4H9NO2/c1-5(2)3-4(6)7/h3H2,1-2H3,(H,6,7)
InChIKeyFFDGPVCHZBVARC-UHFFFAOYSA-N
MW103.12 g/mol
LogP-0.37
Rot. Bonds2

About 2-(dimethylamino)acetic acid

2-(dimethylamino)acetic acid (PubChem CID 673) has the molecular formula C4H9NO2 and a molecular weight of 103.12 g/mol. Its IUPAC name is 2-(dimethylamino)acetic acid.

Molecular Properties

Compound Name2-(dimethylamino)acetic acid
PubChem CID673
Molecular FormulaC4H9NO2
Molecular Weight103.12 g/mol
Exact Mass103.06
IUPAC Name2-(dimethylamino)acetic acid
SMILESCN(C)CC(=O)O
InChIInChI=1S/C4H9NO2/c1-5(2)3-4(6)7/h3H2,1-2H3,(H,6,7)
InChIKeyFFDGPVCHZBVARC-UHFFFAOYSA-N
XLogP-0.37
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.12
LogP ≤ 5-0.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 81569
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CID 24884197
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CID 36938
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CID 39527
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CID 40621
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CID 50163
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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)acetic acid?
The IUPAC name of 2-(dimethylamino)acetic acid (CID 673) is 2-(dimethylamino)acetic acid.
What is the SMILES notation for 2-(dimethylamino)acetic acid?
The canonical SMILES for 2-(dimethylamino)acetic acid is CN(C)CC(=O)O.
What is the InChIKey of 2-(dimethylamino)acetic acid?
The InChIKey is FFDGPVCHZBVARC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO2/c1-5(2)3-4(6)7/h3H2,1-2H3,(H,6,7).
What are the key properties of 2-(dimethylamino)acetic acid?
2-(dimethylamino)acetic acid has a molecular weight of 103.12 g/mol, XLogP of -0.37, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)acetic acid is sourced from PubChem (CID 673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).