N-ethyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetamide

C9H13N3O2 — CID 137304332

IUPACN-ethyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetamide
SMILESCCNC(=O)Cc1nc(C)cc(=O)[nH]1
InChIInChI=1S/C9H13N3O2/c1-3-10-8(13)5-7-11-6(2)4-9(14)12-7/h4H,3,5H2,1-2H3,(H,10,13)(H,11,12,14)
InChIKeySACXGNFXMKBGLO-UHFFFAOYSA-N
MW195.22 g/mol
LogP-0.24
Rot. Bonds3

About N-ethyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetamide

N-ethyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetamide (PubChem CID 137304332) has the molecular formula C9H13N3O2 and a molecular weight of 195.22 g/mol. Its IUPAC name is N-ethyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetamide.

Molecular Properties

Compound NameN-ethyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetamide
PubChem CID137304332
Molecular FormulaC9H13N3O2
Molecular Weight195.22 g/mol
Exact Mass195.10
IUPAC NameN-ethyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetamide
SMILESCCNC(=O)Cc1nc(C)cc(=O)[nH]1
InChIInChI=1S/C9H13N3O2/c1-3-10-8(13)5-7-11-6(2)4-9(14)12-7/h4H,3,5H2,1-2H3,(H,10,13)(H,11,12,14)
InChIKeySACXGNFXMKBGLO-UHFFFAOYSA-N
XLogP-0.24
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 5-0.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetamide?
The IUPAC name of N-ethyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetamide (CID 137304332) is N-ethyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetamide.
What is the SMILES notation for N-ethyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetamide?
The canonical SMILES for N-ethyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetamide is CCNC(=O)Cc1nc(C)cc(=O)[nH]1.
What is the InChIKey of N-ethyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetamide?
The InChIKey is SACXGNFXMKBGLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2/c1-3-10-8(13)5-7-11-6(2)4-9(14)12-7/h4H,3,5H2,1-2H3,(H,10,13)(H,11,12,14).
What are the key properties of N-ethyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetamide?
N-ethyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetamide has a molecular weight of 195.22 g/mol, XLogP of -0.24, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetamide is sourced from PubChem (CID 137304332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).