2-(2-amino-6-oxo-1H-purin-2-yl)acetamide

C7H8N6O2 — CID 19903244

IUPAC2-(2-amino-6-oxo-1H-purin-2-yl)acetamide
SMILESNC(=O)CC1(N)N=C2N=CN=C2C(=O)N1
InChIInChI=1S/C7H8N6O2/c8-3(14)1-7(9)12-5-4(6(15)13-7)10-2-11-5/h2H,1,9H2,(H2,8,14)(H,13,15)
InChIKeyAXRHOQUHBMGAON-UHFFFAOYSA-N
MW208.18 g/mol
LogP-2.51
Rot. Bonds2

About 2-(2-amino-6-oxo-1H-purin-2-yl)acetamide

2-(2-amino-6-oxo-1H-purin-2-yl)acetamide (PubChem CID 19903244) has the molecular formula C7H8N6O2 and a molecular weight of 208.18 g/mol. Its IUPAC name is 2-(2-amino-6-oxo-1H-purin-2-yl)acetamide.

Molecular Properties

Compound Name2-(2-amino-6-oxo-1H-purin-2-yl)acetamide
PubChem CID19903244
Molecular FormulaC7H8N6O2
Molecular Weight208.18 g/mol
Exact Mass208.07
IUPAC Name2-(2-amino-6-oxo-1H-purin-2-yl)acetamide
SMILESNC(=O)CC1(N)N=C2N=CN=C2C(=O)N1
InChIInChI=1S/C7H8N6O2/c8-3(14)1-7(9)12-5-4(6(15)13-7)10-2-11-5/h2H,1,9H2,(H2,8,14)(H,13,15)
InChIKeyAXRHOQUHBMGAON-UHFFFAOYSA-N
XLogP-2.51
TPSA135.29 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.18
LogP ≤ 5-2.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-6-oxo-1H-purin-2-yl)acetamide?
The IUPAC name of 2-(2-amino-6-oxo-1H-purin-2-yl)acetamide (CID 19903244) is 2-(2-amino-6-oxo-1H-purin-2-yl)acetamide.
What is the SMILES notation for 2-(2-amino-6-oxo-1H-purin-2-yl)acetamide?
The canonical SMILES for 2-(2-amino-6-oxo-1H-purin-2-yl)acetamide is NC(=O)CC1(N)N=C2N=CN=C2C(=O)N1.
What is the InChIKey of 2-(2-amino-6-oxo-1H-purin-2-yl)acetamide?
The InChIKey is AXRHOQUHBMGAON-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N6O2/c8-3(14)1-7(9)12-5-4(6(15)13-7)10-2-11-5/h2H,1,9H2,(H2,8,14)(H,13,15).
What are the key properties of 2-(2-amino-6-oxo-1H-purin-2-yl)acetamide?
2-(2-amino-6-oxo-1H-purin-2-yl)acetamide has a molecular weight of 208.18 g/mol, XLogP of -2.51, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-6-oxo-1H-purin-2-yl)acetamide is sourced from PubChem (CID 19903244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).