2-[[2-(2-chlorophenoxy)acetyl]amino]acetic acid

C10H10ClNO4 — CID 9170949

IUPAC2-[[2-(2-chlorophenoxy)acetyl]amino]acetic acid
SMILESO=C(O)CNC(=O)COc1ccccc1Cl
InChIInChI=1S/C10H10ClNO4/c11-7-3-1-2-4-8(7)16-6-9(13)12-5-10(14)15/h1-4H,5-6H2,(H,12,13)(H,14,15)
InChIKeyLUUHUEIDRPZNSN-UHFFFAOYSA-N
MW243.65 g/mol
LogP0.92
Rot. Bonds5

About 2-[[2-(2-chlorophenoxy)acetyl]amino]acetic acid

2-[[2-(2-chlorophenoxy)acetyl]amino]acetic acid (PubChem CID 9170949) has the molecular formula C10H10ClNO4 and a molecular weight of 243.65 g/mol. Its IUPAC name is 2-[[2-(2-chlorophenoxy)acetyl]amino]acetic acid.

Molecular Properties

Compound Name2-[[2-(2-chlorophenoxy)acetyl]amino]acetic acid
PubChem CID9170949
Molecular FormulaC10H10ClNO4
Molecular Weight243.65 g/mol
Exact Mass243.03
IUPAC Name2-[[2-(2-chlorophenoxy)acetyl]amino]acetic acid
SMILESO=C(O)CNC(=O)COc1ccccc1Cl
InChIInChI=1S/C10H10ClNO4/c11-7-3-1-2-4-8(7)16-6-9(13)12-5-10(14)15/h1-4H,5-6H2,(H,12,13)(H,14,15)
InChIKeyLUUHUEIDRPZNSN-UHFFFAOYSA-N
XLogP0.92
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.65
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[[2-(2-chlorophenoxy)acetyl]amino]acetate
CID 43404773
2-[[2-(2-bromophenoxy)acetyl]amino]acetic acid
CID 19176585
4-[[2-(2-chlorophenoxy)acetyl]amino]butanoic acid
CID 43239206
2-[[4-[[2-(2-chlorophenoxy)acetyl]amino]benzoyl]amino]acetic acid
CID 45434890
2-[[2-(2-chlorophenoxy)acetyl]amino]-N-propylacetamide
CID 9011744
2-(2-chlorophenoxy)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 134026861
2-(2-chlorophenoxy)-N-hydroxyacetamide
CID 95562486
2-(2-chlorophenoxy)-N-phenylacetamide
CID 853450
N'-[2-(2-chlorophenoxy)acetyl]-3-phenylpropanehydrazide
CID 3139333
2-(2-chlorophenoxy)-N-[2-[[2-(2-chlorophenoxy)acetyl]amino]phenyl]acetamide
CID 1032604
2-(2-chlorophenoxy)-N-[(4-fluorophenyl)methyl]acetamide
CID 2631895
2-[[2-(2-bromo-4-chlorophenoxy)acetyl]amino]acetic acid
CID 43091937

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-chlorophenoxy)acetyl]amino]acetic acid?
The IUPAC name of 2-[[2-(2-chlorophenoxy)acetyl]amino]acetic acid (CID 9170949) is 2-[[2-(2-chlorophenoxy)acetyl]amino]acetic acid.
What is the SMILES notation for 2-[[2-(2-chlorophenoxy)acetyl]amino]acetic acid?
The canonical SMILES for 2-[[2-(2-chlorophenoxy)acetyl]amino]acetic acid is O=C(O)CNC(=O)COc1ccccc1Cl.
What is the InChIKey of 2-[[2-(2-chlorophenoxy)acetyl]amino]acetic acid?
The InChIKey is LUUHUEIDRPZNSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClNO4/c11-7-3-1-2-4-8(7)16-6-9(13)12-5-10(14)15/h1-4H,5-6H2,(H,12,13)(H,14,15).
What are the key properties of 2-[[2-(2-chlorophenoxy)acetyl]amino]acetic acid?
2-[[2-(2-chlorophenoxy)acetyl]amino]acetic acid has a molecular weight of 243.65 g/mol, XLogP of 0.92, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-chlorophenoxy)acetyl]amino]acetic acid is sourced from PubChem (CID 9170949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).