N-(2-amino-5,6-dimethylpyrimidin-4-yl)acetamide

C8H12N4O — CID 143012525

IUPACN-(2-amino-5,6-dimethylpyrimidin-4-yl)acetamide
SMILESCC(=O)Nc1nc(N)nc(C)c1C
InChIInChI=1S/C8H12N4O/c1-4-5(2)10-8(9)12-7(4)11-6(3)13/h1-3H3,(H3,9,10,11,12,13)
InChIKeyZHYRTLBZXXCVNO-UHFFFAOYSA-N
MW180.21 g/mol
LogP0.63
Rot. Bonds1

About N-(2-amino-5,6-dimethylpyrimidin-4-yl)acetamide

N-(2-amino-5,6-dimethylpyrimidin-4-yl)acetamide (PubChem CID 143012525) has the molecular formula C8H12N4O and a molecular weight of 180.21 g/mol. Its IUPAC name is N-(2-amino-5,6-dimethylpyrimidin-4-yl)acetamide.

Molecular Properties

Compound NameN-(2-amino-5,6-dimethylpyrimidin-4-yl)acetamide
PubChem CID143012525
Molecular FormulaC8H12N4O
Molecular Weight180.21 g/mol
Exact Mass180.10
IUPAC NameN-(2-amino-5,6-dimethylpyrimidin-4-yl)acetamide
SMILESCC(=O)Nc1nc(N)nc(C)c1C
InChIInChI=1S/C8H12N4O/c1-4-5(2)10-8(9)12-7(4)11-6(3)13/h1-3H3,(H3,9,10,11,12,13)
InChIKeyZHYRTLBZXXCVNO-UHFFFAOYSA-N
XLogP0.63
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-5,6-dimethylpyrimidin-4-yl)acetamide?
The IUPAC name of N-(2-amino-5,6-dimethylpyrimidin-4-yl)acetamide (CID 143012525) is N-(2-amino-5,6-dimethylpyrimidin-4-yl)acetamide.
What is the SMILES notation for N-(2-amino-5,6-dimethylpyrimidin-4-yl)acetamide?
The canonical SMILES for N-(2-amino-5,6-dimethylpyrimidin-4-yl)acetamide is CC(=O)Nc1nc(N)nc(C)c1C.
What is the InChIKey of N-(2-amino-5,6-dimethylpyrimidin-4-yl)acetamide?
The InChIKey is ZHYRTLBZXXCVNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O/c1-4-5(2)10-8(9)12-7(4)11-6(3)13/h1-3H3,(H3,9,10,11,12,13).
What are the key properties of N-(2-amino-5,6-dimethylpyrimidin-4-yl)acetamide?
N-(2-amino-5,6-dimethylpyrimidin-4-yl)acetamide has a molecular weight of 180.21 g/mol, XLogP of 0.63, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-5,6-dimethylpyrimidin-4-yl)acetamide is sourced from PubChem (CID 143012525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).