2-(3-cyclopropyl-2,6-dioxopyrimidin-1-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide

C19H20N4O4 — CID 167954325

IUPAC2-(3-cyclopropyl-2,6-dioxopyrimidin-1-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESO=C(Cn1c(=O)ccn(C2CC2)c1=O)Nc1ccccc1N1CCCC1=O
InChIInChI=1S/C19H20N4O4/c24-16(12-23-18(26)9-11-21(19(23)27)13-7-8-13)20-14-4-1-2-5-15(14)22-10-3-6-17(22)25/h1-2,4-5,9,11,13H,3,6-8,10,12H2,(H,20,24)
InChIKeyKODFXHZFVVJCBT-UHFFFAOYSA-N
MW368.39 g/mol
LogP1.11
Rot. Bonds5

About 2-(3-cyclopropyl-2,6-dioxopyrimidin-1-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide

2-(3-cyclopropyl-2,6-dioxopyrimidin-1-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide (PubChem CID 167954325) has the molecular formula C19H20N4O4 and a molecular weight of 368.39 g/mol. Its IUPAC name is 2-(3-cyclopropyl-2,6-dioxopyrimidin-1-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(3-cyclopropyl-2,6-dioxopyrimidin-1-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
PubChem CID167954325
Molecular FormulaC19H20N4O4
Molecular Weight368.39 g/mol
Exact Mass368.15
IUPAC Name2-(3-cyclopropyl-2,6-dioxopyrimidin-1-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESO=C(Cn1c(=O)ccn(C2CC2)c1=O)Nc1ccccc1N1CCCC1=O
InChIInChI=1S/C19H20N4O4/c24-16(12-23-18(26)9-11-21(19(23)27)13-7-8-13)20-14-4-1-2-5-15(14)22-10-3-6-17(22)25/h1-2,4-5,9,11,13H,3,6-8,10,12H2,(H,20,24)
InChIKeyKODFXHZFVVJCBT-UHFFFAOYSA-N
XLogP1.11
TPSA93.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.39
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclopropyl-2,6-dioxopyrimidin-1-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The IUPAC name of 2-(3-cyclopropyl-2,6-dioxopyrimidin-1-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide (CID 167954325) is 2-(3-cyclopropyl-2,6-dioxopyrimidin-1-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide.
What is the SMILES notation for 2-(3-cyclopropyl-2,6-dioxopyrimidin-1-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The canonical SMILES for 2-(3-cyclopropyl-2,6-dioxopyrimidin-1-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide is O=C(Cn1c(=O)ccn(C2CC2)c1=O)Nc1ccccc1N1CCCC1=O.
What is the InChIKey of 2-(3-cyclopropyl-2,6-dioxopyrimidin-1-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The InChIKey is KODFXHZFVVJCBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O4/c24-16(12-23-18(26)9-11-21(19(23)27)13-7-8-13)20-14-4-1-2-5-15(14)22-10-3-6-17(22)25/h1-2,4-5,9,11,13H,3,6-8,10,12H2,(H,20,24).
What are the key properties of 2-(3-cyclopropyl-2,6-dioxopyrimidin-1-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
2-(3-cyclopropyl-2,6-dioxopyrimidin-1-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide has a molecular weight of 368.39 g/mol, XLogP of 1.11, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopropyl-2,6-dioxopyrimidin-1-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide is sourced from PubChem (CID 167954325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).