2-[[2-(thiophen-2-ylamino)acetyl]amino]acetic acid

C8H10N2O3S — CID 19834262

IUPAC2-[[2-(thiophen-2-ylamino)acetyl]amino]acetic acid
SMILESO=C(O)CNC(=O)CNc1cccs1
InChIInChI=1S/C8H10N2O3S/c11-6(9-5-8(12)13)4-10-7-2-1-3-14-7/h1-3,10H,4-5H2,(H,9,11)(H,12,13)
InChIKeyOAKOYAQTSBGRDP-UHFFFAOYSA-N
MW214.25 g/mol
LogP0.36
Rot. Bonds5

About 2-[[2-(thiophen-2-ylamino)acetyl]amino]acetic acid

2-[[2-(thiophen-2-ylamino)acetyl]amino]acetic acid (PubChem CID 19834262) has the molecular formula C8H10N2O3S and a molecular weight of 214.25 g/mol. Its IUPAC name is 2-[[2-(thiophen-2-ylamino)acetyl]amino]acetic acid.

Molecular Properties

Compound Name2-[[2-(thiophen-2-ylamino)acetyl]amino]acetic acid
PubChem CID19834262
Molecular FormulaC8H10N2O3S
Molecular Weight214.25 g/mol
Exact Mass214.04
IUPAC Name2-[[2-(thiophen-2-ylamino)acetyl]amino]acetic acid
SMILESO=C(O)CNC(=O)CNc1cccs1
InChIInChI=1S/C8H10N2O3S/c11-6(9-5-8(12)13)4-10-7-2-1-3-14-7/h1-3,10H,4-5H2,(H,9,11)(H,12,13)
InChIKeyOAKOYAQTSBGRDP-UHFFFAOYSA-N
XLogP0.36
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.25
LogP ≤ 50.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-(thiophen-2-ylamino)acetyl]amino]acetic acid?
The IUPAC name of 2-[[2-(thiophen-2-ylamino)acetyl]amino]acetic acid (CID 19834262) is 2-[[2-(thiophen-2-ylamino)acetyl]amino]acetic acid.
What is the SMILES notation for 2-[[2-(thiophen-2-ylamino)acetyl]amino]acetic acid?
The canonical SMILES for 2-[[2-(thiophen-2-ylamino)acetyl]amino]acetic acid is O=C(O)CNC(=O)CNc1cccs1.
What is the InChIKey of 2-[[2-(thiophen-2-ylamino)acetyl]amino]acetic acid?
The InChIKey is OAKOYAQTSBGRDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O3S/c11-6(9-5-8(12)13)4-10-7-2-1-3-14-7/h1-3,10H,4-5H2,(H,9,11)(H,12,13).
What are the key properties of 2-[[2-(thiophen-2-ylamino)acetyl]amino]acetic acid?
2-[[2-(thiophen-2-ylamino)acetyl]amino]acetic acid has a molecular weight of 214.25 g/mol, XLogP of 0.36, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(thiophen-2-ylamino)acetyl]amino]acetic acid is sourced from PubChem (CID 19834262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).