2-(2,5-dioxoimidazolidin-1-yl)-N-[[(4R)-1-methyl-2-oxo-3,4-dihydroquinolin-4-yl]methyl]acetamide

C16H18N4O4 — CID 99927072

IUPAC2-(2,5-dioxoimidazolidin-1-yl)-N-[[(4R)-1-methyl-2-oxo-3,4-dihydroquinolin-4-yl]methyl]acetamide
SMILESCN1C(=O)C[C@@H](CNC(=O)CN2C(=O)CNC2=O)c2ccccc21
InChIInChI=1S/C16H18N4O4/c1-19-12-5-3-2-4-11(12)10(6-14(19)22)7-17-13(21)9-20-15(23)8-18-16(20)24/h2-5,10H,6-9H2,1H3,(H,17,21)(H,18,24)/t10-/m0/s1
InChIKeyADQVRGKIVDAEKZ-JTQLQIEISA-N
MW330.34 g/mol
LogP-0.20
Rot. Bonds4

About 2-(2,5-dioxoimidazolidin-1-yl)-N-[[(4R)-1-methyl-2-oxo-3,4-dihydroquinolin-4-yl]methyl]acetamide

2-(2,5-dioxoimidazolidin-1-yl)-N-[[(4R)-1-methyl-2-oxo-3,4-dihydroquinolin-4-yl]methyl]acetamide (PubChem CID 99927072) has the molecular formula C16H18N4O4 and a molecular weight of 330.34 g/mol. Its IUPAC name is 2-(2,5-dioxoimidazolidin-1-yl)-N-[[(4R)-1-methyl-2-oxo-3,4-dihydroquinolin-4-yl]methyl]acetamide.

Molecular Properties

Compound Name2-(2,5-dioxoimidazolidin-1-yl)-N-[[(4R)-1-methyl-2-oxo-3,4-dihydroquinolin-4-yl]methyl]acetamide
PubChem CID99927072
Molecular FormulaC16H18N4O4
Molecular Weight330.34 g/mol
Exact Mass330.13
IUPAC Name2-(2,5-dioxoimidazolidin-1-yl)-N-[[(4R)-1-methyl-2-oxo-3,4-dihydroquinolin-4-yl]methyl]acetamide
SMILESCN1C(=O)C[C@@H](CNC(=O)CN2C(=O)CNC2=O)c2ccccc21
InChIInChI=1S/C16H18N4O4/c1-19-12-5-3-2-4-11(12)10(6-14(19)22)7-17-13(21)9-20-15(23)8-18-16(20)24/h2-5,10H,6-9H2,1H3,(H,17,21)(H,18,24)/t10-/m0/s1
InChIKeyADQVRGKIVDAEKZ-JTQLQIEISA-N
XLogP-0.20
TPSA98.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.34
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dioxoimidazolidin-1-yl)-N-[[(4R)-1-methyl-2-oxo-3,4-dihydroquinolin-4-yl]methyl]acetamide?
The IUPAC name of 2-(2,5-dioxoimidazolidin-1-yl)-N-[[(4R)-1-methyl-2-oxo-3,4-dihydroquinolin-4-yl]methyl]acetamide (CID 99927072) is 2-(2,5-dioxoimidazolidin-1-yl)-N-[[(4R)-1-methyl-2-oxo-3,4-dihydroquinolin-4-yl]methyl]acetamide.
What is the SMILES notation for 2-(2,5-dioxoimidazolidin-1-yl)-N-[[(4R)-1-methyl-2-oxo-3,4-dihydroquinolin-4-yl]methyl]acetamide?
The canonical SMILES for 2-(2,5-dioxoimidazolidin-1-yl)-N-[[(4R)-1-methyl-2-oxo-3,4-dihydroquinolin-4-yl]methyl]acetamide is CN1C(=O)C[C@@H](CNC(=O)CN2C(=O)CNC2=O)c2ccccc21.
What is the InChIKey of 2-(2,5-dioxoimidazolidin-1-yl)-N-[[(4R)-1-methyl-2-oxo-3,4-dihydroquinolin-4-yl]methyl]acetamide?
The InChIKey is ADQVRGKIVDAEKZ-JTQLQIEISA-N. The full InChI is InChI=1S/C16H18N4O4/c1-19-12-5-3-2-4-11(12)10(6-14(19)22)7-17-13(21)9-20-15(23)8-18-16(20)24/h2-5,10H,6-9H2,1H3,(H,17,21)(H,18,24)/t10-/m0/s1.
What are the key properties of 2-(2,5-dioxoimidazolidin-1-yl)-N-[[(4R)-1-methyl-2-oxo-3,4-dihydroquinolin-4-yl]methyl]acetamide?
2-(2,5-dioxoimidazolidin-1-yl)-N-[[(4R)-1-methyl-2-oxo-3,4-dihydroquinolin-4-yl]methyl]acetamide has a molecular weight of 330.34 g/mol, XLogP of -0.20, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dioxoimidazolidin-1-yl)-N-[[(4R)-1-methyl-2-oxo-3,4-dihydroquinolin-4-yl]methyl]acetamide is sourced from PubChem (CID 99927072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).