N-cyclopropyl-2-(2,4-dioxopyrimidin-1-yl)acetamide

C9H11N3O3 — CID 37345436

IUPACN-cyclopropyl-2-(2,4-dioxopyrimidin-1-yl)acetamide
SMILESO=C(Cn1ccc(=O)[nH]c1=O)NC1CC1
InChIInChI=1S/C9H11N3O3/c13-7-3-4-12(9(15)11-7)5-8(14)10-6-1-2-6/h3-4,6H,1-2,5H2,(H,10,14)(H,11,13,15)
InChIKeySIQTXJULCJPMBV-UHFFFAOYSA-N
MW209.20 g/mol
LogP-1.18
Rot. Bonds3

About N-cyclopropyl-2-(2,4-dioxopyrimidin-1-yl)acetamide

N-cyclopropyl-2-(2,4-dioxopyrimidin-1-yl)acetamide (PubChem CID 37345436) has the molecular formula C9H11N3O3 and a molecular weight of 209.20 g/mol. Its IUPAC name is N-cyclopropyl-2-(2,4-dioxopyrimidin-1-yl)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(2,4-dioxopyrimidin-1-yl)acetamide
PubChem CID37345436
Molecular FormulaC9H11N3O3
Molecular Weight209.20 g/mol
Exact Mass209.08
IUPAC NameN-cyclopropyl-2-(2,4-dioxopyrimidin-1-yl)acetamide
SMILESO=C(Cn1ccc(=O)[nH]c1=O)NC1CC1
InChIInChI=1S/C9H11N3O3/c13-7-3-4-12(9(15)11-7)5-8(14)10-6-1-2-6/h3-4,6H,1-2,5H2,(H,10,14)(H,11,13,15)
InChIKeySIQTXJULCJPMBV-UHFFFAOYSA-N
XLogP-1.18
TPSA83.96 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 5-1.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-3-(2,4-dioxopyrimidin-1-yl)propanamide
CID 108788640
N-[(1S)-2,3-dihydro-1H-inden-1-yl]-2-(2,4-dioxopyrimidin-1-yl)acetamide
CID 51642054
2-(2,4-dioxopyrimidin-1-yl)acetohydrazide
CID 43236986
2-(2,4-dioxopyrimidin-1-yl)-N-methylacetamide
CID 60699315
N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-2-(2,4-dioxopyrimidin-1-yl)acetamide
CID 24614392
N-carbamoyl-2-(2,4-dioxopyrimidin-1-yl)acetamide
CID 63812524
N-(2-chloroprop-2-enyl)-2-(2,4-dioxopyrimidin-1-yl)acetamide
CID 115636712
N-[(1R,3R)-3-aminocyclopentyl]-3-(2,4-dioxopyrimidin-1-yl)propanamide;hydrochloride
CID 154888784
N-[(1S,5R)-3-benzyl-3-azabicyclo[3.1.0]hexan-6-yl]-2-(2,4-dioxopyrimidin-1-yl)acetamide
CID 136586428
2-(2,4-dioxopyrimidin-1-yl)-N-propylacetamide
CID 30662441
2-(2,4-dioxopyrimidin-1-yl)-N-[(2S)-2-hydroxypropyl]acetamide
CID 83030551
2-(2,4-dioxopyrimidin-1-yl)-N-pyridin-4-ylacetamide
CID 39953760

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(2,4-dioxopyrimidin-1-yl)acetamide?
The IUPAC name of N-cyclopropyl-2-(2,4-dioxopyrimidin-1-yl)acetamide (CID 37345436) is N-cyclopropyl-2-(2,4-dioxopyrimidin-1-yl)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(2,4-dioxopyrimidin-1-yl)acetamide?
The canonical SMILES for N-cyclopropyl-2-(2,4-dioxopyrimidin-1-yl)acetamide is O=C(Cn1ccc(=O)[nH]c1=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-(2,4-dioxopyrimidin-1-yl)acetamide?
The InChIKey is SIQTXJULCJPMBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O3/c13-7-3-4-12(9(15)11-7)5-8(14)10-6-1-2-6/h3-4,6H,1-2,5H2,(H,10,14)(H,11,13,15).
What are the key properties of N-cyclopropyl-2-(2,4-dioxopyrimidin-1-yl)acetamide?
N-cyclopropyl-2-(2,4-dioxopyrimidin-1-yl)acetamide has a molecular weight of 209.20 g/mol, XLogP of -1.18, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(2,4-dioxopyrimidin-1-yl)acetamide is sourced from PubChem (CID 37345436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).