2-[[2-[[2-(2H-tetrazol-5-yl)acetyl]amino]acetyl]amino]acetic acid

C7H10N6O4 — CID 110496459

IUPAC2-[[2-[[2-(2H-tetrazol-5-yl)acetyl]amino]acetyl]amino]acetic acid
SMILESO=C(O)CNC(=O)CNC(=O)Cc1nn[nH]n1
InChIInChI=1S/C7H10N6O4/c14-5(1-4-10-12-13-11-4)8-2-6(15)9-3-7(16)17/h1-3H2,(H,8,14)(H,9,15)(H,16,17)(H,10,11,12,13)
InChIKeyQYIUMMUNXNUZAD-UHFFFAOYSA-N
MW242.19 g/mol
LogP-2.94
Rot. Bonds6

About 2-[[2-[[2-(2H-tetrazol-5-yl)acetyl]amino]acetyl]amino]acetic acid

2-[[2-[[2-(2H-tetrazol-5-yl)acetyl]amino]acetyl]amino]acetic acid (PubChem CID 110496459) has the molecular formula C7H10N6O4 and a molecular weight of 242.19 g/mol. Its IUPAC name is 2-[[2-[[2-(2H-tetrazol-5-yl)acetyl]amino]acetyl]amino]acetic acid.

Molecular Properties

Compound Name2-[[2-[[2-(2H-tetrazol-5-yl)acetyl]amino]acetyl]amino]acetic acid
PubChem CID110496459
Molecular FormulaC7H10N6O4
Molecular Weight242.19 g/mol
Exact Mass242.08
IUPAC Name2-[[2-[[2-(2H-tetrazol-5-yl)acetyl]amino]acetyl]amino]acetic acid
SMILESO=C(O)CNC(=O)CNC(=O)Cc1nn[nH]n1
InChIInChI=1S/C7H10N6O4/c14-5(1-4-10-12-13-11-4)8-2-6(15)9-3-7(16)17/h1-3H2,(H,8,14)(H,9,15)(H,16,17)(H,10,11,12,13)
InChIKeyQYIUMMUNXNUZAD-UHFFFAOYSA-N
XLogP-2.94
TPSA149.96 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.19
LogP ≤ 5-2.94
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Analyze 2-[[2-[[2-(2H-tetrazol-5-yl)acetyl]amino]acetyl]amino]acetic acid with MolForge

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Related Compounds

2-[[2-(2H-tetrazol-5-yl)acetyl]amino]acetic acid
CID 20357904
3-(2H-tetrazole-5-carbonylamino)propanoic acid
CID 80361575
2-[[2-(2H-tetrazol-5-yl)acetyl]amino]butanoic acid
CID 110496455
2-[2-(2H-tetrazol-5-yl)ethylamino]acetic acid
CID 13525510
2-[[2-(2H-tetrazol-5-ylmethylcarbamoylamino)acetyl]amino]acetic acid
CID 61867888
2-oxo-2-[1-(2H-tetrazol-5-yl)ethylamino]acetic acid
CID 61868103
2-oxo-2-(2H-tetrazol-5-ylmethylamino)acetic acid
CID 61868707
2-[[2-[1-(2H-tetrazol-5-yl)ethylcarbamoylamino]acetyl]amino]acetic acid
CID 61869888
3-amino-3-hydroxyimino-N-(2H-tetrazol-5-ylmethyl)propanamide
CID 76927219
2-[[2-(2H-tetrazole-5-carbonylamino)acetyl]amino]acetic acid
CID 80361475
3-[(1H-tetrazol-5-ylcarbonyl)amino]-L-alanine
CID 102182982
5-oxo-1-(2H-tetrazole-5-carbonyl)piperazine-2-carboxylic acid
CID 107433031

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[[2-(2H-tetrazol-5-yl)acetyl]amino]acetyl]amino]acetic acid?
The IUPAC name of 2-[[2-[[2-(2H-tetrazol-5-yl)acetyl]amino]acetyl]amino]acetic acid (CID 110496459) is 2-[[2-[[2-(2H-tetrazol-5-yl)acetyl]amino]acetyl]amino]acetic acid.
What is the SMILES notation for 2-[[2-[[2-(2H-tetrazol-5-yl)acetyl]amino]acetyl]amino]acetic acid?
The canonical SMILES for 2-[[2-[[2-(2H-tetrazol-5-yl)acetyl]amino]acetyl]amino]acetic acid is O=C(O)CNC(=O)CNC(=O)Cc1nn[nH]n1.
What is the InChIKey of 2-[[2-[[2-(2H-tetrazol-5-yl)acetyl]amino]acetyl]amino]acetic acid?
The InChIKey is QYIUMMUNXNUZAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N6O4/c14-5(1-4-10-12-13-11-4)8-2-6(15)9-3-7(16)17/h1-3H2,(H,8,14)(H,9,15)(H,16,17)(H,10,11,12,13).
What are the key properties of 2-[[2-[[2-(2H-tetrazol-5-yl)acetyl]amino]acetyl]amino]acetic acid?
2-[[2-[[2-(2H-tetrazol-5-yl)acetyl]amino]acetyl]amino]acetic acid has a molecular weight of 242.19 g/mol, XLogP of -2.94, 6 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[[2-(2H-tetrazol-5-yl)acetyl]amino]acetyl]amino]acetic acid is sourced from PubChem (CID 110496459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).