N-(2-amino-4-chloro-6-oxo-1H-pyrimidin-5-yl)acetamide

C6H7ClN4O2 — CID 135454048

IUPACN-(2-amino-4-chloro-6-oxo-1H-pyrimidin-5-yl)acetamide
SMILESCC(=O)Nc1c(Cl)nc(N)[nH]c1=O
InChIInChI=1S/C6H7ClN4O2/c1-2(12)9-3-4(7)10-6(8)11-5(3)13/h1H3,(H,9,12)(H3,8,10,11,13)
InChIKeyFESOPUJFJLFPPO-UHFFFAOYSA-N
MW202.60 g/mol
LogP-0.04
Rot. Bonds1

About N-(2-amino-4-chloro-6-oxo-1H-pyrimidin-5-yl)acetamide

N-(2-amino-4-chloro-6-oxo-1H-pyrimidin-5-yl)acetamide (PubChem CID 135454048) has the molecular formula C6H7ClN4O2 and a molecular weight of 202.60 g/mol. Its IUPAC name is N-(2-amino-4-chloro-6-oxo-1H-pyrimidin-5-yl)acetamide.

Molecular Properties

Compound NameN-(2-amino-4-chloro-6-oxo-1H-pyrimidin-5-yl)acetamide
PubChem CID135454048
Molecular FormulaC6H7ClN4O2
Molecular Weight202.60 g/mol
Exact Mass202.03
IUPAC NameN-(2-amino-4-chloro-6-oxo-1H-pyrimidin-5-yl)acetamide
SMILESCC(=O)Nc1c(Cl)nc(N)[nH]c1=O
InChIInChI=1S/C6H7ClN4O2/c1-2(12)9-3-4(7)10-6(8)11-5(3)13/h1H3,(H,9,12)(H3,8,10,11,13)
InChIKeyFESOPUJFJLFPPO-UHFFFAOYSA-N
XLogP-0.04
TPSA100.87 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.60
LogP ≤ 5-0.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4,6-dichloro-2-oxo-1H-pyridin-3-yl)acetamide
CID 23242570
N-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)-4-chlorobenzamide
CID 66758533
N-(5-amino-3,6-dioxo-1,2-dihydropyridazin-4-yl)acetamide
CID 13221217
N-(3-acetamido-2,6-dichloro-4-pyridinyl)acetamide
CID 162624908
N-[4-amino-2-(2-hydrazinyl-2-oxoethyl)sulfanyl-6-oxo-1H-pyrimidin-5-yl]acetamide
CID 171713921
N-[2-amino-4-(methylamino)-6-oxo-1H-pyrimidin-5-yl]-2,2,2-trifluoroacetamide
CID 171384109
N-(4-amino-2-chloro-3-pyridinyl)acetamide
CID 45119288
N-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetamide
CID 45071779
N-(2-amino-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)-2-methoxyacetamide
CID 66758413
N-(4,6-dichloro-2-phenylpyrimidin-5-yl)acetamide
CID 86260174
2-amino-5-chloro-4-methyl-1H-pyrimidin-6-one
CID 135905258
2-amino-4-(4-chloroanilino)-6-oxo-1H-pyrimidine-5-carboxamide
CID 135854192

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-chloro-6-oxo-1H-pyrimidin-5-yl)acetamide?
The IUPAC name of N-(2-amino-4-chloro-6-oxo-1H-pyrimidin-5-yl)acetamide (CID 135454048) is N-(2-amino-4-chloro-6-oxo-1H-pyrimidin-5-yl)acetamide.
What is the SMILES notation for N-(2-amino-4-chloro-6-oxo-1H-pyrimidin-5-yl)acetamide?
The canonical SMILES for N-(2-amino-4-chloro-6-oxo-1H-pyrimidin-5-yl)acetamide is CC(=O)Nc1c(Cl)nc(N)[nH]c1=O.
What is the InChIKey of N-(2-amino-4-chloro-6-oxo-1H-pyrimidin-5-yl)acetamide?
The InChIKey is FESOPUJFJLFPPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7ClN4O2/c1-2(12)9-3-4(7)10-6(8)11-5(3)13/h1H3,(H,9,12)(H3,8,10,11,13).
What are the key properties of N-(2-amino-4-chloro-6-oxo-1H-pyrimidin-5-yl)acetamide?
N-(2-amino-4-chloro-6-oxo-1H-pyrimidin-5-yl)acetamide has a molecular weight of 202.60 g/mol, XLogP of -0.04, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-chloro-6-oxo-1H-pyrimidin-5-yl)acetamide is sourced from PubChem (CID 135454048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).