N-methyl-2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)amino]acetamide

C8H12N4O2 — CID 136956046

IUPACN-methyl-2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)amino]acetamide
SMILESCNC(=O)CNc1cc(=O)[nH]c(C)n1
InChIInChI=1S/C8H12N4O2/c1-5-11-6(3-7(13)12-5)10-4-8(14)9-2/h3H,4H2,1-2H3,(H,9,14)(H2,10,11,12,13)
InChIKeyYUWNERMRQZWFHV-UHFFFAOYSA-N
MW196.21 g/mol
LogP-0.76
Rot. Bonds3

About N-methyl-2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)amino]acetamide

N-methyl-2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)amino]acetamide (PubChem CID 136956046) has the molecular formula C8H12N4O2 and a molecular weight of 196.21 g/mol. Its IUPAC name is N-methyl-2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)amino]acetamide.

Molecular Properties

Compound NameN-methyl-2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)amino]acetamide
PubChem CID136956046
Molecular FormulaC8H12N4O2
Molecular Weight196.21 g/mol
Exact Mass196.10
IUPAC NameN-methyl-2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)amino]acetamide
SMILESCNC(=O)CNc1cc(=O)[nH]c(C)n1
InChIInChI=1S/C8H12N4O2/c1-5-11-6(3-7(13)12-5)10-4-8(14)9-2/h3H,4H2,1-2H3,(H,9,14)(H2,10,11,12,13)
InChIKeyYUWNERMRQZWFHV-UHFFFAOYSA-N
XLogP-0.76
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 5-0.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)amino]acetamide?
The IUPAC name of N-methyl-2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)amino]acetamide (CID 136956046) is N-methyl-2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)amino]acetamide.
What is the SMILES notation for N-methyl-2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)amino]acetamide?
The canonical SMILES for N-methyl-2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)amino]acetamide is CNC(=O)CNc1cc(=O)[nH]c(C)n1.
What is the InChIKey of N-methyl-2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)amino]acetamide?
The InChIKey is YUWNERMRQZWFHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O2/c1-5-11-6(3-7(13)12-5)10-4-8(14)9-2/h3H,4H2,1-2H3,(H,9,14)(H2,10,11,12,13).
What are the key properties of N-methyl-2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)amino]acetamide?
N-methyl-2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)amino]acetamide has a molecular weight of 196.21 g/mol, XLogP of -0.76, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)amino]acetamide is sourced from PubChem (CID 136956046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).