N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide

C14H18N4O4 — CID 122280758

IUPACN-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
SMILESO=C(CN1CCOC1=O)NCCn1nc2c(cc1=O)CCC2
InChIInChI=1S/C14H18N4O4/c19-12(9-17-6-7-22-14(17)21)15-4-5-18-13(20)8-10-2-1-3-11(10)16-18/h8H,1-7,9H2,(H,15,19)
InChIKeyIBFYJXZDCAWQOR-UHFFFAOYSA-N
MW306.32 g/mol
LogP-0.70
Rot. Bonds5

About N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide

N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide (PubChem CID 122280758) has the molecular formula C14H18N4O4 and a molecular weight of 306.32 g/mol. Its IUPAC name is N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide.

Molecular Properties

Compound NameN-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
PubChem CID122280758
Molecular FormulaC14H18N4O4
Molecular Weight306.32 g/mol
Exact Mass306.13
IUPAC NameN-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
SMILESO=C(CN1CCOC1=O)NCCn1nc2c(cc1=O)CCC2
InChIInChI=1S/C14H18N4O4/c19-12(9-17-6-7-22-14(17)21)15-4-5-18-13(20)8-10-2-1-3-11(10)16-18/h8H,1-7,9H2,(H,15,19)
InChIKeyIBFYJXZDCAWQOR-UHFFFAOYSA-N
XLogP-0.70
TPSA93.53 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.32
LogP ≤ 5-0.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide?
The IUPAC name of N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide (CID 122280758) is N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide.
What is the SMILES notation for N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide?
The canonical SMILES for N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide is O=C(CN1CCOC1=O)NCCn1nc2c(cc1=O)CCC2.
What is the InChIKey of N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide?
The InChIKey is IBFYJXZDCAWQOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O4/c19-12(9-17-6-7-22-14(17)21)15-4-5-18-13(20)8-10-2-1-3-11(10)16-18/h8H,1-7,9H2,(H,15,19).
What are the key properties of N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide?
N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide has a molecular weight of 306.32 g/mol, XLogP of -0.70, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide is sourced from PubChem (CID 122280758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).