4-(2,5-dioxopyrrolidin-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide

C20H20N4O4 — CID 18140140

IUPAC4-(2,5-dioxopyrrolidin-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide
SMILESO=C(Nc1ccc(N2CCOCC2)nc1)c1ccc(N2C(=O)CCC2=O)cc1
InChIInChI=1S/C20H20N4O4/c25-18-7-8-19(26)24(18)16-4-1-14(2-5-16)20(27)22-15-3-6-17(21-13-15)23-9-11-28-12-10-23/h1-6,13H,7-12H2,(H,22,27)
InChIKeyGYDNFIUYVJHOEM-UHFFFAOYSA-N
MW380.40 g/mol
LogP1.82
Rot. Bonds4

About 4-(2,5-dioxopyrrolidin-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide

4-(2,5-dioxopyrrolidin-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide (PubChem CID 18140140) has the molecular formula C20H20N4O4 and a molecular weight of 380.40 g/mol. Its IUPAC name is 4-(2,5-dioxopyrrolidin-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide.

Molecular Properties

Compound Name4-(2,5-dioxopyrrolidin-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide
PubChem CID18140140
Molecular FormulaC20H20N4O4
Molecular Weight380.40 g/mol
Exact Mass380.15
IUPAC Name4-(2,5-dioxopyrrolidin-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide
SMILESO=C(Nc1ccc(N2CCOCC2)nc1)c1ccc(N2C(=O)CCC2=O)cc1
InChIInChI=1S/C20H20N4O4/c25-18-7-8-19(26)24(18)16-4-1-14(2-5-16)20(27)22-15-3-6-17(21-13-15)23-9-11-28-12-10-23/h1-6,13H,7-12H2,(H,22,27)
InChIKeyGYDNFIUYVJHOEM-UHFFFAOYSA-N
XLogP1.82
TPSA91.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.40
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dioxopyrrolidin-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide?
The IUPAC name of 4-(2,5-dioxopyrrolidin-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide (CID 18140140) is 4-(2,5-dioxopyrrolidin-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide.
What is the SMILES notation for 4-(2,5-dioxopyrrolidin-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide?
The canonical SMILES for 4-(2,5-dioxopyrrolidin-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide is O=C(Nc1ccc(N2CCOCC2)nc1)c1ccc(N2C(=O)CCC2=O)cc1.
What is the InChIKey of 4-(2,5-dioxopyrrolidin-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide?
The InChIKey is GYDNFIUYVJHOEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O4/c25-18-7-8-19(26)24(18)16-4-1-14(2-5-16)20(27)22-15-3-6-17(21-13-15)23-9-11-28-12-10-23/h1-6,13H,7-12H2,(H,22,27).
What are the key properties of 4-(2,5-dioxopyrrolidin-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide?
4-(2,5-dioxopyrrolidin-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide has a molecular weight of 380.40 g/mol, XLogP of 1.82, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dioxopyrrolidin-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)benzamide is sourced from PubChem (CID 18140140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).