N-ethyl-3-(3-ethyl-2,6-dioxopyrimidin-1-yl)propanamide

C11H17N3O3 — CID 63811070

IUPACN-ethyl-3-(3-ethyl-2,6-dioxopyrimidin-1-yl)propanamide
SMILESCCNC(=O)CCn1c(=O)ccn(CC)c1=O
InChIInChI=1S/C11H17N3O3/c1-3-12-9(15)5-8-14-10(16)6-7-13(4-2)11(14)17/h6-7H,3-5,8H2,1-2H3,(H,12,15)
InChIKeyVIXBJIVFMPSSQA-UHFFFAOYSA-N
MW239.27 g/mol
LogP-0.44
Rot. Bonds5

About N-ethyl-3-(3-ethyl-2,6-dioxopyrimidin-1-yl)propanamide

N-ethyl-3-(3-ethyl-2,6-dioxopyrimidin-1-yl)propanamide (PubChem CID 63811070) has the molecular formula C11H17N3O3 and a molecular weight of 239.27 g/mol. Its IUPAC name is N-ethyl-3-(3-ethyl-2,6-dioxopyrimidin-1-yl)propanamide.

Molecular Properties

Compound NameN-ethyl-3-(3-ethyl-2,6-dioxopyrimidin-1-yl)propanamide
PubChem CID63811070
Molecular FormulaC11H17N3O3
Molecular Weight239.27 g/mol
Exact Mass239.13
IUPAC NameN-ethyl-3-(3-ethyl-2,6-dioxopyrimidin-1-yl)propanamide
SMILESCCNC(=O)CCn1c(=O)ccn(CC)c1=O
InChIInChI=1S/C11H17N3O3/c1-3-12-9(15)5-8-14-10(16)6-7-13(4-2)11(14)17/h6-7H,3-5,8H2,1-2H3,(H,12,15)
InChIKeyVIXBJIVFMPSSQA-UHFFFAOYSA-N
XLogP-0.44
TPSA73.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 5-0.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(3-ethyl-2,6-dioxopyrimidin-1-yl)-N-methylbutanamide
CID 63892960
3-(5-amino-3-ethyl-2,6-dioxopyrimidin-1-yl)-N-ethylpropanamide
CID 63800797
tert-butyl 3-(3-ethyl-2,6-dioxopyrimidin-1-yl)propanoate
CID 116662713
1-ethyl-3-[3-(ethylamino)propyl]pyrimidine-2,4-dione
CID 63810571
3-butyl-1-ethylpyrimidine-2,4-dione
CID 63812534
N-ethyl-3-(3-methyl-2-oxoimidazol-1-yl)propanamide
CID 116624442
2-(3-ethyl-2,6-dioxopyrimidin-1-yl)-N-(2-methylpropyl)acetamide
CID 60735082
N-ethyl-3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)propanamide
CID 14956315
1-ethyl-3-[2-(pentylamino)ethyl]pyrimidine-2,4-dione
CID 63811359
1-ethyl-3-(3-ethylsulfonylpropyl)pyrimidine-2,4-dione
CID 65097190
3-(4-chloro-2-ethyl-6-oxopyrimidin-1-yl)-N-ethylpropanamide
CID 114584435
2-(2,6-dioxo-3-propylpyrimidin-1-yl)-N-prop-2-ynylacetamide
CID 63812383

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(3-ethyl-2,6-dioxopyrimidin-1-yl)propanamide?
The IUPAC name of N-ethyl-3-(3-ethyl-2,6-dioxopyrimidin-1-yl)propanamide (CID 63811070) is N-ethyl-3-(3-ethyl-2,6-dioxopyrimidin-1-yl)propanamide.
What is the SMILES notation for N-ethyl-3-(3-ethyl-2,6-dioxopyrimidin-1-yl)propanamide?
The canonical SMILES for N-ethyl-3-(3-ethyl-2,6-dioxopyrimidin-1-yl)propanamide is CCNC(=O)CCn1c(=O)ccn(CC)c1=O.
What is the InChIKey of N-ethyl-3-(3-ethyl-2,6-dioxopyrimidin-1-yl)propanamide?
The InChIKey is VIXBJIVFMPSSQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3/c1-3-12-9(15)5-8-14-10(16)6-7-13(4-2)11(14)17/h6-7H,3-5,8H2,1-2H3,(H,12,15).
What are the key properties of N-ethyl-3-(3-ethyl-2,6-dioxopyrimidin-1-yl)propanamide?
N-ethyl-3-(3-ethyl-2,6-dioxopyrimidin-1-yl)propanamide has a molecular weight of 239.27 g/mol, XLogP of -0.44, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(3-ethyl-2,6-dioxopyrimidin-1-yl)propanamide is sourced from PubChem (CID 63811070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).