2-amino-2-(5-chloro-1-methylimidazol-2-yl)acetamide

C6H9ClN4O — CID 130490763

IUPAC2-amino-2-(5-chloro-1-methylimidazol-2-yl)acetamide
SMILESCn1c(Cl)cnc1C(N)C(N)=O
InChIInChI=1S/C6H9ClN4O/c1-11-3(7)2-10-6(11)4(8)5(9)12/h2,4H,8H2,1H3,(H2,9,12)
InChIKeyOTDLXHUAPVOUQZ-UHFFFAOYSA-N
MW188.62 g/mol
LogP-0.44
Rot. Bonds2

About 2-amino-2-(5-chloro-1-methylimidazol-2-yl)acetamide

2-amino-2-(5-chloro-1-methylimidazol-2-yl)acetamide (PubChem CID 130490763) has the molecular formula C6H9ClN4O and a molecular weight of 188.62 g/mol. Its IUPAC name is 2-amino-2-(5-chloro-1-methylimidazol-2-yl)acetamide.

Molecular Properties

Compound Name2-amino-2-(5-chloro-1-methylimidazol-2-yl)acetamide
PubChem CID130490763
Molecular FormulaC6H9ClN4O
Molecular Weight188.62 g/mol
Exact Mass188.05
IUPAC Name2-amino-2-(5-chloro-1-methylimidazol-2-yl)acetamide
SMILESCn1c(Cl)cnc1C(N)C(N)=O
InChIInChI=1S/C6H9ClN4O/c1-11-3(7)2-10-6(11)4(8)5(9)12/h2,4H,8H2,1H3,(H2,9,12)
InChIKeyOTDLXHUAPVOUQZ-UHFFFAOYSA-N
XLogP-0.44
TPSA86.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.62
LogP ≤ 5-0.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-amino-2-(5-chloro-1-methylimidazol-2-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(5-chloro-1-methylimidazol-2-yl)acetamide?
The IUPAC name of 2-amino-2-(5-chloro-1-methylimidazol-2-yl)acetamide (CID 130490763) is 2-amino-2-(5-chloro-1-methylimidazol-2-yl)acetamide.
What is the SMILES notation for 2-amino-2-(5-chloro-1-methylimidazol-2-yl)acetamide?
The canonical SMILES for 2-amino-2-(5-chloro-1-methylimidazol-2-yl)acetamide is Cn1c(Cl)cnc1C(N)C(N)=O.
What is the InChIKey of 2-amino-2-(5-chloro-1-methylimidazol-2-yl)acetamide?
The InChIKey is OTDLXHUAPVOUQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9ClN4O/c1-11-3(7)2-10-6(11)4(8)5(9)12/h2,4H,8H2,1H3,(H2,9,12).
What are the key properties of 2-amino-2-(5-chloro-1-methylimidazol-2-yl)acetamide?
2-amino-2-(5-chloro-1-methylimidazol-2-yl)acetamide has a molecular weight of 188.62 g/mol, XLogP of -0.44, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(5-chloro-1-methylimidazol-2-yl)acetamide is sourced from PubChem (CID 130490763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).