N-(6-methoxy-3-pyridinyl)-3-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide

C18H19N5O4 — CID 51130038

IUPACN-(6-methoxy-3-pyridinyl)-3-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide
SMILESCOc1ccc(NC(=O)c2cccc(NCC(=O)N3CCNC3=O)c2)cn1
InChIInChI=1S/C18H19N5O4/c1-27-15-6-5-14(10-21-15)22-17(25)12-3-2-4-13(9-12)20-11-16(24)23-8-7-19-18(23)26/h2-6,9-10,20H,7-8,11H2,1H3,(H,19,26)(H,22,25)
InChIKeyFDVJVJZVSOQILA-UHFFFAOYSA-N
MW369.38 g/mol
LogP1.31
Rot. Bonds6

About N-(6-methoxy-3-pyridinyl)-3-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide

N-(6-methoxy-3-pyridinyl)-3-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide (PubChem CID 51130038) has the molecular formula C18H19N5O4 and a molecular weight of 369.38 g/mol. Its IUPAC name is N-(6-methoxy-3-pyridinyl)-3-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide.

Molecular Properties

Compound NameN-(6-methoxy-3-pyridinyl)-3-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide
PubChem CID51130038
Molecular FormulaC18H19N5O4
Molecular Weight369.38 g/mol
Exact Mass369.14
IUPAC NameN-(6-methoxy-3-pyridinyl)-3-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide
SMILESCOc1ccc(NC(=O)c2cccc(NCC(=O)N3CCNC3=O)c2)cn1
InChIInChI=1S/C18H19N5O4/c1-27-15-6-5-14(10-21-15)22-17(25)12-3-2-4-13(9-12)20-11-16(24)23-8-7-19-18(23)26/h2-6,9-10,20H,7-8,11H2,1H3,(H,19,26)(H,22,25)
InChIKeyFDVJVJZVSOQILA-UHFFFAOYSA-N
XLogP1.31
TPSA112.66 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.38
LogP ≤ 51.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(6-methoxy-3-pyridinyl)-3-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide?
The IUPAC name of N-(6-methoxy-3-pyridinyl)-3-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide (CID 51130038) is N-(6-methoxy-3-pyridinyl)-3-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide.
What is the SMILES notation for N-(6-methoxy-3-pyridinyl)-3-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide?
The canonical SMILES for N-(6-methoxy-3-pyridinyl)-3-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide is COc1ccc(NC(=O)c2cccc(NCC(=O)N3CCNC3=O)c2)cn1.
What is the InChIKey of N-(6-methoxy-3-pyridinyl)-3-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide?
The InChIKey is FDVJVJZVSOQILA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O4/c1-27-15-6-5-14(10-21-15)22-17(25)12-3-2-4-13(9-12)20-11-16(24)23-8-7-19-18(23)26/h2-6,9-10,20H,7-8,11H2,1H3,(H,19,26)(H,22,25).
What are the key properties of N-(6-methoxy-3-pyridinyl)-3-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide?
N-(6-methoxy-3-pyridinyl)-3-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide has a molecular weight of 369.38 g/mol, XLogP of 1.31, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxy-3-pyridinyl)-3-[[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]amino]benzamide is sourced from PubChem (CID 51130038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).