2-amino-2-(7-chloroimidazo[1,2-b][1,2,4]triazin-6-yl)acetic acid

C7H6ClN5O2 — CID 83892971

IUPAC2-amino-2-(7-chloroimidazo[1,2-b][1,2,4]triazin-6-yl)acetic acid
SMILESNC(C(=O)O)c1nc2nccnn2c1Cl
InChIInChI=1S/C7H6ClN5O2/c8-5-4(3(9)6(14)15)12-7-10-1-2-11-13(5)7/h1-3H,9H2,(H,14,15)
InChIKeyPBCCQUIDUOWVTQ-UHFFFAOYSA-N
MW227.61 g/mol
LogP-0.14
Rot. Bonds2

About 2-amino-2-(7-chloroimidazo[1,2-b][1,2,4]triazin-6-yl)acetic acid

2-amino-2-(7-chloroimidazo[1,2-b][1,2,4]triazin-6-yl)acetic acid (PubChem CID 83892971) has the molecular formula C7H6ClN5O2 and a molecular weight of 227.61 g/mol. Its IUPAC name is 2-amino-2-(7-chloroimidazo[1,2-b][1,2,4]triazin-6-yl)acetic acid.

Molecular Properties

Compound Name2-amino-2-(7-chloroimidazo[1,2-b][1,2,4]triazin-6-yl)acetic acid
PubChem CID83892971
Molecular FormulaC7H6ClN5O2
Molecular Weight227.61 g/mol
Exact Mass227.02
IUPAC Name2-amino-2-(7-chloroimidazo[1,2-b][1,2,4]triazin-6-yl)acetic acid
SMILESNC(C(=O)O)c1nc2nccnn2c1Cl
InChIInChI=1S/C7H6ClN5O2/c8-5-4(3(9)6(14)15)12-7-10-1-2-11-13(5)7/h1-3H,9H2,(H,14,15)
InChIKeyPBCCQUIDUOWVTQ-UHFFFAOYSA-N
XLogP-0.14
TPSA106.40 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.61
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-amino-2-(7-methylimidazo[1,5-b]pyridazin-5-yl)acetic acid
CID 84673991
2-amino-2-(2-chloropyrimidin-4-yl)acetic acid
CID 134264029
2-amino-2-(2-hydroxypyrazol-3-yl)acetic acid
CID 11412520
2-amino-2-(2-chloro-3-pyridinyl)acetic acid
CID 55270966
2-amino-2-(5-chloro-1-methylimidazol-2-yl)acetic acid
CID 130490759
3-(3-chloroimidazo[1,2-b]pyridazin-2-yl)butanoic acid
CID 84701547
(2R)-2-amino-2-(1-methylimidazol-2-yl)acetic acid
CID 26597297
7-carbamoylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid
CID 59462465
2-amino-2-(3-methoxy-2-pyridinyl)acetic acid
CID 55295273
2-amino-2-(5-bromopyrimidin-4-yl)acetic acid
CID 83895013
2-(8-oxopyrimido[1,2-b][1,2,4]triazin-7-yl)acetamide
CID 139979795
2-amino-2-(6-chloroimidazo[1,2-a]pyrazin-3-yl)acetic acid
CID 84690684

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(7-chloroimidazo[1,2-b][1,2,4]triazin-6-yl)acetic acid?
The IUPAC name of 2-amino-2-(7-chloroimidazo[1,2-b][1,2,4]triazin-6-yl)acetic acid (CID 83892971) is 2-amino-2-(7-chloroimidazo[1,2-b][1,2,4]triazin-6-yl)acetic acid.
What is the SMILES notation for 2-amino-2-(7-chloroimidazo[1,2-b][1,2,4]triazin-6-yl)acetic acid?
The canonical SMILES for 2-amino-2-(7-chloroimidazo[1,2-b][1,2,4]triazin-6-yl)acetic acid is NC(C(=O)O)c1nc2nccnn2c1Cl.
What is the InChIKey of 2-amino-2-(7-chloroimidazo[1,2-b][1,2,4]triazin-6-yl)acetic acid?
The InChIKey is PBCCQUIDUOWVTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClN5O2/c8-5-4(3(9)6(14)15)12-7-10-1-2-11-13(5)7/h1-3H,9H2,(H,14,15).
What are the key properties of 2-amino-2-(7-chloroimidazo[1,2-b][1,2,4]triazin-6-yl)acetic acid?
2-amino-2-(7-chloroimidazo[1,2-b][1,2,4]triazin-6-yl)acetic acid has a molecular weight of 227.61 g/mol, XLogP of -0.14, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(7-chloroimidazo[1,2-b][1,2,4]triazin-6-yl)acetic acid is sourced from PubChem (CID 83892971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).