N-(2-chlorophenyl)-2-(2,4-dioxo-1H-pyrimidin-3-yl)acetamide

C12H10ClN3O3 — CID 103600179

IUPACN-(2-chlorophenyl)-2-(2,4-dioxo-1H-pyrimidin-3-yl)acetamide
SMILESO=C(Cn1c(=O)cc[nH]c1=O)Nc1ccccc1Cl
InChIInChI=1S/C12H10ClN3O3/c13-8-3-1-2-4-9(8)15-10(17)7-16-11(18)5-6-14-12(16)19/h1-6H,7H2,(H,14,19)(H,15,17)
InChIKeySBRYOYOETYLUQN-UHFFFAOYSA-N
MW279.68 g/mol
LogP0.83
Rot. Bonds3

About N-(2-chlorophenyl)-2-(2,4-dioxo-1H-pyrimidin-3-yl)acetamide

N-(2-chlorophenyl)-2-(2,4-dioxo-1H-pyrimidin-3-yl)acetamide (PubChem CID 103600179) has the molecular formula C12H10ClN3O3 and a molecular weight of 279.68 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-(2,4-dioxo-1H-pyrimidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-(2,4-dioxo-1H-pyrimidin-3-yl)acetamide
PubChem CID103600179
Molecular FormulaC12H10ClN3O3
Molecular Weight279.68 g/mol
Exact Mass279.04
IUPAC NameN-(2-chlorophenyl)-2-(2,4-dioxo-1H-pyrimidin-3-yl)acetamide
SMILESO=C(Cn1c(=O)cc[nH]c1=O)Nc1ccccc1Cl
InChIInChI=1S/C12H10ClN3O3/c13-8-3-1-2-4-9(8)15-10(17)7-16-11(18)5-6-14-12(16)19/h1-6H,7H2,(H,14,19)(H,15,17)
InChIKeySBRYOYOETYLUQN-UHFFFAOYSA-N
XLogP0.83
TPSA83.96 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.68
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-bromo-2,4-dioxo-1H-pyrimidin-3-yl)-N-(2-chlorophenyl)acetamide
CID 107104201
N-(2-chlorophenyl)-2-(2,5-dioxopyrrolidin-1-yl)acetamide
CID 17034752
N-(2-chlorophenyl)-2-sulfanylacetamide
CID 679489
N-(2-chlorophenyl)-2-pyrrolidin-1-ylacetamide;hydrochloride
CID 24832355
2-(azepan-1-yl)-N-(2-chlorophenyl)acetamide
CID 2070988
2-[[2-(2-chloroanilino)-2-oxoethyl]disulfanyl]-N-(2-chlorophenyl)acetamide
CID 71330084
N-(3-chloro-2-methylphenyl)-2-(2-oxo-3H-benzimidazol-1-yl)acetamide
CID 113195248
2-(5-bromo-2,4-dioxopyrimidin-1-yl)-N-(2-chlorophenyl)acetamide
CID 27448932
N-(2-chlorophenyl)-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide
CID 4779873
N-(2-chlorophenyl)-2-(2,3,5,6-tetrachlorophenyl)sulfanylacetamide
CID 2822568
N-(2-chlorophenyl)-2-(2-oxo-4-phenylquinazolin-1-yl)acetamide
CID 8721690
2-[4-[2-(2-chloroanilino)-2-oxoethyl]piperazin-1-yl]-N-(2-methylphenyl)acetamide
CID 29161450

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-(2,4-dioxo-1H-pyrimidin-3-yl)acetamide?
The IUPAC name of N-(2-chlorophenyl)-2-(2,4-dioxo-1H-pyrimidin-3-yl)acetamide (CID 103600179) is N-(2-chlorophenyl)-2-(2,4-dioxo-1H-pyrimidin-3-yl)acetamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-(2,4-dioxo-1H-pyrimidin-3-yl)acetamide?
The canonical SMILES for N-(2-chlorophenyl)-2-(2,4-dioxo-1H-pyrimidin-3-yl)acetamide is O=C(Cn1c(=O)cc[nH]c1=O)Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-2-(2,4-dioxo-1H-pyrimidin-3-yl)acetamide?
The InChIKey is SBRYOYOETYLUQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClN3O3/c13-8-3-1-2-4-9(8)15-10(17)7-16-11(18)5-6-14-12(16)19/h1-6H,7H2,(H,14,19)(H,15,17).
What are the key properties of N-(2-chlorophenyl)-2-(2,4-dioxo-1H-pyrimidin-3-yl)acetamide?
N-(2-chlorophenyl)-2-(2,4-dioxo-1H-pyrimidin-3-yl)acetamide has a molecular weight of 279.68 g/mol, XLogP of 0.83, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-(2,4-dioxo-1H-pyrimidin-3-yl)acetamide is sourced from PubChem (CID 103600179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).