N'-(quinoline-2-carbonyl)-1,3-oxazole-4-carbohydrazide

C14H10N4O3 — CID 166194916

IUPACN'-(quinoline-2-carbonyl)-1,3-oxazole-4-carbohydrazide
SMILESO=C(NNC(=O)c1ccc2ccccc2n1)c1cocn1
InChIInChI=1S/C14H10N4O3/c19-13(17-18-14(20)12-7-21-8-15-12)11-6-5-9-3-1-2-4-10(9)16-11/h1-8H,(H,17,19)(H,18,20)
InChIKeyORWGYYBFZHFTOS-UHFFFAOYSA-N
MW282.26 g/mol
LogP1.30
Rot. Bonds2

About N'-(quinoline-2-carbonyl)-1,3-oxazole-4-carbohydrazide

N'-(quinoline-2-carbonyl)-1,3-oxazole-4-carbohydrazide (PubChem CID 166194916) has the molecular formula C14H10N4O3 and a molecular weight of 282.26 g/mol. Its IUPAC name is N'-(quinoline-2-carbonyl)-1,3-oxazole-4-carbohydrazide.

Molecular Properties

Compound NameN'-(quinoline-2-carbonyl)-1,3-oxazole-4-carbohydrazide
PubChem CID166194916
Molecular FormulaC14H10N4O3
Molecular Weight282.26 g/mol
Exact Mass282.08
IUPAC NameN'-(quinoline-2-carbonyl)-1,3-oxazole-4-carbohydrazide
SMILESO=C(NNC(=O)c1ccc2ccccc2n1)c1cocn1
InChIInChI=1S/C14H10N4O3/c19-13(17-18-14(20)12-7-21-8-15-12)11-6-5-9-3-1-2-4-10(9)16-11/h1-8H,(H,17,19)(H,18,20)
InChIKeyORWGYYBFZHFTOS-UHFFFAOYSA-N
XLogP1.30
TPSA97.12 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.26
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N'-(quinoline-2-carbonyl)-1,3-oxazole-4-carbohydrazide 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

N'-(cyclopropanecarbonyl)quinoline-2-carbohydrazide
CID 26798961
N'-(4-fluorobenzoyl)quinoline-2-carbohydrazide
CID 7779547
N'-(3,5-dimethylbenzoyl)quinoline-2-carbohydrazide
CID 29266891
N'-butanoylquinoline-2-carbohydrazide
CID 29266790
N'-(2-naphthalen-2-ylsulfanylacetyl)quinoline-2-carbohydrazide
CID 35064538
N'-[5-(phenoxymethyl)furan-2-carbonyl]quinoline-2-carbohydrazide
CID 9219810
N'-(2-ethoxybenzoyl)quinoline-2-carbohydrazide
CID 29266895
N'-(5-bromothiophene-2-carbonyl)quinoline-2-carbohydrazide
CID 4787478
N'-(3-fluorobenzoyl)quinoline-2-carbohydrazide
CID 35063560
N'-(2-benzo[e][1]benzofuran-1-ylacetyl)quinoline-2-carbohydrazide
CID 29266482
N-(2-chlorophenyl)quinoline-2-carboxamide
CID 878226
N'-[2-(2-fluorophenyl)sulfanylacetyl]quinoline-2-carbohydrazide
CID 7780075

Frequently Asked Questions

What is the IUPAC name of N'-(quinoline-2-carbonyl)-1,3-oxazole-4-carbohydrazide?
The IUPAC name of N'-(quinoline-2-carbonyl)-1,3-oxazole-4-carbohydrazide (CID 166194916) is N'-(quinoline-2-carbonyl)-1,3-oxazole-4-carbohydrazide.
What is the SMILES notation for N'-(quinoline-2-carbonyl)-1,3-oxazole-4-carbohydrazide?
The canonical SMILES for N'-(quinoline-2-carbonyl)-1,3-oxazole-4-carbohydrazide is O=C(NNC(=O)c1ccc2ccccc2n1)c1cocn1.
What is the InChIKey of N'-(quinoline-2-carbonyl)-1,3-oxazole-4-carbohydrazide?
The InChIKey is ORWGYYBFZHFTOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N4O3/c19-13(17-18-14(20)12-7-21-8-15-12)11-6-5-9-3-1-2-4-10(9)16-11/h1-8H,(H,17,19)(H,18,20).
What are the key properties of N'-(quinoline-2-carbonyl)-1,3-oxazole-4-carbohydrazide?
N'-(quinoline-2-carbonyl)-1,3-oxazole-4-carbohydrazide has a molecular weight of 282.26 g/mol, XLogP of 1.30, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(quinoline-2-carbonyl)-1,3-oxazole-4-carbohydrazide is sourced from PubChem (CID 166194916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).