N-[3-[3-(2-fluorophenoxy)propyl]-4-oxoquinazolin-7-yl]-2-hydroxyacetamide

C19H18FN3O4 — CID 67361570

IUPACN-[3-[3-(2-fluorophenoxy)propyl]-4-oxoquinazolin-7-yl]-2-hydroxyacetamide
SMILESO=C(CO)Nc1ccc2c(=O)n(CCCOc3ccccc3F)cnc2c1
InChIInChI=1S/C19H18FN3O4/c20-15-4-1-2-5-17(15)27-9-3-8-23-12-21-16-10-13(22-18(25)11-24)6-7-14(16)19(23)26/h1-2,4-7,10,12,24H,3,8-9,11H2,(H,22,25)
InChIKeyZPNOFXLIUYCILJ-UHFFFAOYSA-N
MW371.37 g/mol
LogP1.94
Rot. Bonds7

About N-[3-[3-(2-fluorophenoxy)propyl]-4-oxoquinazolin-7-yl]-2-hydroxyacetamide

N-[3-[3-(2-fluorophenoxy)propyl]-4-oxoquinazolin-7-yl]-2-hydroxyacetamide (PubChem CID 67361570) has the molecular formula C19H18FN3O4 and a molecular weight of 371.37 g/mol. Its IUPAC name is N-[3-[3-(2-fluorophenoxy)propyl]-4-oxoquinazolin-7-yl]-2-hydroxyacetamide.

Molecular Properties

Compound NameN-[3-[3-(2-fluorophenoxy)propyl]-4-oxoquinazolin-7-yl]-2-hydroxyacetamide
PubChem CID67361570
Molecular FormulaC19H18FN3O4
Molecular Weight371.37 g/mol
Exact Mass371.13
IUPAC NameN-[3-[3-(2-fluorophenoxy)propyl]-4-oxoquinazolin-7-yl]-2-hydroxyacetamide
SMILESO=C(CO)Nc1ccc2c(=O)n(CCCOc3ccccc3F)cnc2c1
InChIInChI=1S/C19H18FN3O4/c20-15-4-1-2-5-17(15)27-9-3-8-23-12-21-16-10-13(22-18(25)11-24)6-7-14(16)19(23)26/h1-2,4-7,10,12,24H,3,8-9,11H2,(H,22,25)
InChIKeyZPNOFXLIUYCILJ-UHFFFAOYSA-N
XLogP1.94
TPSA93.45 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.37
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze N-[3-[3-(2-fluorophenoxy)propyl]-4-oxoquinazolin-7-yl]-2-hydroxyacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

benzyl N-[3-[3-(2-fluorophenoxy)propyl]-4-oxoquinazolin-6-yl]carbamate
CID 46208552
[4-oxo-3-[3-[2-(trifluoromethyl)phenoxy]propyl]quinazolin-6-yl]carbamic acid
CID 67376888
N-(3-benzyl-4-oxoquinazolin-6-yl)-2-hydroxyacetamide
CID 25155077
N-[2-fluoro-5-[4-(4-oxoquinazolin-3-yl)butanoylamino]phenyl]cyclopropanecarboxamide
CID 30804576
6-(4-oxoquinazolin-3-yl)-N-[4-(trifluoromethoxy)phenyl]hexanamide
CID 4899813
3-[3-(2,3,5-trimethylphenoxy)propyl]quinazolin-4-one
CID 2216367
1-(4-acetylphenyl)-3-[3-(2-methoxyethyl)-4-oxoquinazolin-7-yl]urea
CID 162429447
2-(7-fluoro-4-oxoquinazolin-3-yl)-N-(4-methylphenyl)acetamide
CID 40743532
[2-[[3-[(3-chloro-4-fluorophenyl)methyl]-4-oxoquinazolin-7-yl]amino]-2-oxoethyl] acetate
CID 25158458
7-chloro-3-[(2S)-3-(2-fluorophenoxy)-2-hydroxypropyl]quinazolin-4-one
CID 40895606
[2-(3,4-difluoroanilino)-2-oxoethyl] 2-(4-oxoquinazolin-3-yl)acetate
CID 7995448
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-oxoquinazolin-3-yl)butanamide
CID 4911549

Frequently Asked Questions

What is the IUPAC name of N-[3-[3-(2-fluorophenoxy)propyl]-4-oxoquinazolin-7-yl]-2-hydroxyacetamide?
The IUPAC name of N-[3-[3-(2-fluorophenoxy)propyl]-4-oxoquinazolin-7-yl]-2-hydroxyacetamide (CID 67361570) is N-[3-[3-(2-fluorophenoxy)propyl]-4-oxoquinazolin-7-yl]-2-hydroxyacetamide.
What is the SMILES notation for N-[3-[3-(2-fluorophenoxy)propyl]-4-oxoquinazolin-7-yl]-2-hydroxyacetamide?
The canonical SMILES for N-[3-[3-(2-fluorophenoxy)propyl]-4-oxoquinazolin-7-yl]-2-hydroxyacetamide is O=C(CO)Nc1ccc2c(=O)n(CCCOc3ccccc3F)cnc2c1.
What is the InChIKey of N-[3-[3-(2-fluorophenoxy)propyl]-4-oxoquinazolin-7-yl]-2-hydroxyacetamide?
The InChIKey is ZPNOFXLIUYCILJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3O4/c20-15-4-1-2-5-17(15)27-9-3-8-23-12-21-16-10-13(22-18(25)11-24)6-7-14(16)19(23)26/h1-2,4-7,10,12,24H,3,8-9,11H2,(H,22,25).
What are the key properties of N-[3-[3-(2-fluorophenoxy)propyl]-4-oxoquinazolin-7-yl]-2-hydroxyacetamide?
N-[3-[3-(2-fluorophenoxy)propyl]-4-oxoquinazolin-7-yl]-2-hydroxyacetamide has a molecular weight of 371.37 g/mol, XLogP of 1.94, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[3-(2-fluorophenoxy)propyl]-4-oxoquinazolin-7-yl]-2-hydroxyacetamide is sourced from PubChem (CID 67361570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).