2-(9-oxoacridin-10-yl)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide

C26H24N2O4 — CID 42950421

IUPAC2-(9-oxoacridin-10-yl)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide
SMILESO=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cccc(OCC2CCCO2)c1
InChIInChI=1S/C26H24N2O4/c29-25(27-18-7-5-8-19(15-18)32-17-20-9-6-14-31-20)16-28-23-12-3-1-10-21(23)26(30)22-11-2-4-13-24(22)28/h1-5,7-8,10-13,15,20H,6,9,14,16-17H2,(H,27,29)
InChIKeyQFYGWGKKGSYRIZ-UHFFFAOYSA-N
MW428.49 g/mol
LogP4.35
Rot. Bonds6

About 2-(9-oxoacridin-10-yl)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide

2-(9-oxoacridin-10-yl)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide (PubChem CID 42950421) has the molecular formula C26H24N2O4 and a molecular weight of 428.49 g/mol. Its IUPAC name is 2-(9-oxoacridin-10-yl)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(9-oxoacridin-10-yl)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide
PubChem CID42950421
Molecular FormulaC26H24N2O4
Molecular Weight428.49 g/mol
Exact Mass428.17
IUPAC Name2-(9-oxoacridin-10-yl)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide
SMILESO=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cccc(OCC2CCCO2)c1
InChIInChI=1S/C26H24N2O4/c29-25(27-18-7-5-8-19(15-18)32-17-20-9-6-14-31-20)16-28-23-12-3-1-10-21(23)26(30)22-11-2-4-13-24(22)28/h1-5,7-8,10-13,15,20H,6,9,14,16-17H2,(H,27,29)
InChIKeyQFYGWGKKGSYRIZ-UHFFFAOYSA-N
XLogP4.35
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.49
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide
CID 119284095
N-[4-methyl-2-(oxolan-2-ylmethoxy)phenyl]-2-(9-oxoacridin-10-yl)acetamide
CID 60574719
2-(ethylamino)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide
CID 54820938
4-amino-N-[3-(oxolan-2-ylmethoxy)phenyl]butanamide
CID 119284123
2-(methylamino)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide;hydrochloride
CID 119713691
2-(N-ethylanilino)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide
CID 54808947
3-amino-N-[3-(oxolan-2-ylmethoxy)phenyl]butanamide
CID 119713717
N-naphthalen-2-yl-2-[3-(oxolan-2-ylmethoxy)anilino]acetamide
CID 54828752
1-cyclopropyl-3-[3-(oxolan-2-ylmethoxy)phenyl]urea
CID 47162446
2-(4-chlorophenoxy)-N-[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]acetamide
CID 41444851
3-amino-N-[3-(oxolan-2-ylmethoxy)phenyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 119713684
2-(dipropylamino)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide
CID 54818764

Frequently Asked Questions

What is the IUPAC name of 2-(9-oxoacridin-10-yl)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide?
The IUPAC name of 2-(9-oxoacridin-10-yl)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide (CID 42950421) is 2-(9-oxoacridin-10-yl)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide.
What is the SMILES notation for 2-(9-oxoacridin-10-yl)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide?
The canonical SMILES for 2-(9-oxoacridin-10-yl)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide is O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cccc(OCC2CCCO2)c1.
What is the InChIKey of 2-(9-oxoacridin-10-yl)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide?
The InChIKey is QFYGWGKKGSYRIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N2O4/c29-25(27-18-7-5-8-19(15-18)32-17-20-9-6-14-31-20)16-28-23-12-3-1-10-21(23)26(30)22-11-2-4-13-24(22)28/h1-5,7-8,10-13,15,20H,6,9,14,16-17H2,(H,27,29).
What are the key properties of 2-(9-oxoacridin-10-yl)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide?
2-(9-oxoacridin-10-yl)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide has a molecular weight of 428.49 g/mol, XLogP of 4.35, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(9-oxoacridin-10-yl)-N-[3-(oxolan-2-ylmethoxy)phenyl]acetamide is sourced from PubChem (CID 42950421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).