2-[(2-amino-5-methylpyrimidin-4-yl)amino]acetamide

C7H11N5O — CID 80770293

IUPAC2-[(2-amino-5-methylpyrimidin-4-yl)amino]acetamide
SMILESCc1cnc(N)nc1NCC(N)=O
InChIInChI=1S/C7H11N5O/c1-4-2-11-7(9)12-6(4)10-3-5(8)13/h2H,3H2,1H3,(H2,8,13)(H3,9,10,11,12)
InChIKeyDAHXONYZFGSJKT-UHFFFAOYSA-N
MW181.20 g/mol
LogP-0.74
Rot. Bonds3

About 2-[(2-amino-5-methylpyrimidin-4-yl)amino]acetamide

2-[(2-amino-5-methylpyrimidin-4-yl)amino]acetamide (PubChem CID 80770293) has the molecular formula C7H11N5O and a molecular weight of 181.20 g/mol. Its IUPAC name is 2-[(2-amino-5-methylpyrimidin-4-yl)amino]acetamide.

Molecular Properties

Compound Name2-[(2-amino-5-methylpyrimidin-4-yl)amino]acetamide
PubChem CID80770293
Molecular FormulaC7H11N5O
Molecular Weight181.20 g/mol
Exact Mass181.10
IUPAC Name2-[(2-amino-5-methylpyrimidin-4-yl)amino]acetamide
SMILESCc1cnc(N)nc1NCC(N)=O
InChIInChI=1S/C7H11N5O/c1-4-2-11-7(9)12-6(4)10-3-5(8)13/h2H,3H2,1H3,(H2,8,13)(H3,9,10,11,12)
InChIKeyDAHXONYZFGSJKT-UHFFFAOYSA-N
XLogP-0.74
TPSA106.92 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.20
LogP ≤ 5-0.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-5-methylpyrimidin-4-yl)amino]acetamide?
The IUPAC name of 2-[(2-amino-5-methylpyrimidin-4-yl)amino]acetamide (CID 80770293) is 2-[(2-amino-5-methylpyrimidin-4-yl)amino]acetamide.
What is the SMILES notation for 2-[(2-amino-5-methylpyrimidin-4-yl)amino]acetamide?
The canonical SMILES for 2-[(2-amino-5-methylpyrimidin-4-yl)amino]acetamide is Cc1cnc(N)nc1NCC(N)=O.
What is the InChIKey of 2-[(2-amino-5-methylpyrimidin-4-yl)amino]acetamide?
The InChIKey is DAHXONYZFGSJKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N5O/c1-4-2-11-7(9)12-6(4)10-3-5(8)13/h2H,3H2,1H3,(H2,8,13)(H3,9,10,11,12).
What are the key properties of 2-[(2-amino-5-methylpyrimidin-4-yl)amino]acetamide?
2-[(2-amino-5-methylpyrimidin-4-yl)amino]acetamide has a molecular weight of 181.20 g/mol, XLogP of -0.74, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-5-methylpyrimidin-4-yl)amino]acetamide is sourced from PubChem (CID 80770293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).