2-(5-fluoro-2-oxo-1,4-dihydroquinazolin-3-yl)-N-hydroxyacetamide

C10H10FN3O3 — CID 10752478

IUPAC2-(5-fluoro-2-oxo-1,4-dihydroquinazolin-3-yl)-N-hydroxyacetamide
SMILESO=C(CN1Cc2c(F)cccc2NC1=O)NO
InChIInChI=1S/C10H10FN3O3/c11-7-2-1-3-8-6(7)4-14(10(16)12-8)5-9(15)13-17/h1-3,17H,4-5H2,(H,12,16)(H,13,15)
InChIKeyKTBMCENDCYXNHT-UHFFFAOYSA-N
MW239.21 g/mol
LogP0.68
Rot. Bonds2

About 2-(5-fluoro-2-oxo-1,4-dihydroquinazolin-3-yl)-N-hydroxyacetamide

2-(5-fluoro-2-oxo-1,4-dihydroquinazolin-3-yl)-N-hydroxyacetamide (PubChem CID 10752478) has the molecular formula C10H10FN3O3 and a molecular weight of 239.21 g/mol. Its IUPAC name is 2-(5-fluoro-2-oxo-1,4-dihydroquinazolin-3-yl)-N-hydroxyacetamide.

Molecular Properties

Compound Name2-(5-fluoro-2-oxo-1,4-dihydroquinazolin-3-yl)-N-hydroxyacetamide
PubChem CID10752478
Molecular FormulaC10H10FN3O3
Molecular Weight239.21 g/mol
Exact Mass239.07
IUPAC Name2-(5-fluoro-2-oxo-1,4-dihydroquinazolin-3-yl)-N-hydroxyacetamide
SMILESO=C(CN1Cc2c(F)cccc2NC1=O)NO
InChIInChI=1S/C10H10FN3O3/c11-7-2-1-3-8-6(7)4-14(10(16)12-8)5-9(15)13-17/h1-3,17H,4-5H2,(H,12,16)(H,13,15)
InChIKeyKTBMCENDCYXNHT-UHFFFAOYSA-N
XLogP0.68
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.21
LogP ≤ 50.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3,4-Dihydro-3-methyl-2(1H)-quinazolinone
CID 3846558
1,2,3,4-Tetrahydroquinazolin-2-one
CID 12360756
2-(4-Acetyl-piperazin-1-yl)-N-(5-fluoro-2-methyl-phenyl)-acetamide
CID 1448807
2-(3,4-dihydro-2H-quinolin-1-yl)-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 2548699
2-[3-(4-Fluoro-phenyl)-1-(2-nitro-benzyl)-ureido]-N-hydroxy-propionamide
CID 44312195
2-[4-(3-Phenyl-ureido)-piperidin-1-yl]-N-o-tolyl-acetamide
CID 649315
N-(benzylcarbamoyl)-2-(3,4-dihydro-2H-quinolin-1-yl)acetamide
CID 2401887
N-{2-[(3-fluoro-4-methylphenyl)amino]-2-oxoethyl}-3-hydroxyquinoxaline-1(2H)-carboxamide
CID 8034686
N-{3-[(4-fluorobenzyl)amino]-3-oxopropyl}-3-hydroxyquinoxaline-1(2H)-carboxamide
CID 8071570
N-(2-{[2-(3-fluorophenyl)ethyl]amino}-2-oxoethyl)-3-hydroxyquinoxaline-1(2H)-carboxamide
CID 8072277
N-(3-{[2-(3-fluorophenyl)ethyl]amino}-3-oxopropyl)-3-hydroxyquinoxaline-1(2H)-carboxamide
CID 8073214
2-(5-Bromo-2-oxo-1,4-dihydro-2H-quinazolin-3-yl)-N-hydroxy-acetamide
CID 10086145

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-2-oxo-1,4-dihydroquinazolin-3-yl)-N-hydroxyacetamide?
The IUPAC name of 2-(5-fluoro-2-oxo-1,4-dihydroquinazolin-3-yl)-N-hydroxyacetamide (CID 10752478) is 2-(5-fluoro-2-oxo-1,4-dihydroquinazolin-3-yl)-N-hydroxyacetamide.
What is the SMILES notation for 2-(5-fluoro-2-oxo-1,4-dihydroquinazolin-3-yl)-N-hydroxyacetamide?
The canonical SMILES for 2-(5-fluoro-2-oxo-1,4-dihydroquinazolin-3-yl)-N-hydroxyacetamide is O=C(CN1Cc2c(F)cccc2NC1=O)NO.
What is the InChIKey of 2-(5-fluoro-2-oxo-1,4-dihydroquinazolin-3-yl)-N-hydroxyacetamide?
The InChIKey is KTBMCENDCYXNHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3O3/c11-7-2-1-3-8-6(7)4-14(10(16)12-8)5-9(15)13-17/h1-3,17H,4-5H2,(H,12,16)(H,13,15).
What are the key properties of 2-(5-fluoro-2-oxo-1,4-dihydroquinazolin-3-yl)-N-hydroxyacetamide?
2-(5-fluoro-2-oxo-1,4-dihydroquinazolin-3-yl)-N-hydroxyacetamide has a molecular weight of 239.21 g/mol, XLogP of 0.68, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-2-oxo-1,4-dihydroquinazolin-3-yl)-N-hydroxyacetamide is sourced from PubChem (CID 10752478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).