N-(3-fluorophenyl)-4-methyl-1,2-oxazole-3-carboxamide

C11H9FN2O2 — CID 110862667

IUPACN-(3-fluorophenyl)-4-methyl-1,2-oxazole-3-carboxamide
SMILESCc1conc1C(=O)Nc1cccc(F)c1
InChIInChI=1S/C11H9FN2O2/c1-7-6-16-14-10(7)11(15)13-9-4-2-3-8(12)5-9/h2-6H,1H3,(H,13,15)
InChIKeyNHTKQMCFJHDNKA-UHFFFAOYSA-N
MW220.20 g/mol
LogP2.37
Rot. Bonds2

About N-(3-fluorophenyl)-4-methyl-1,2-oxazole-3-carboxamide

N-(3-fluorophenyl)-4-methyl-1,2-oxazole-3-carboxamide (PubChem CID 110862667) has the molecular formula C11H9FN2O2 and a molecular weight of 220.20 g/mol. Its IUPAC name is N-(3-fluorophenyl)-4-methyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-4-methyl-1,2-oxazole-3-carboxamide
PubChem CID110862667
Molecular FormulaC11H9FN2O2
Molecular Weight220.20 g/mol
Exact Mass220.06
IUPAC NameN-(3-fluorophenyl)-4-methyl-1,2-oxazole-3-carboxamide
SMILESCc1conc1C(=O)Nc1cccc(F)c1
InChIInChI=1S/C11H9FN2O2/c1-7-6-16-14-10(7)11(15)13-9-4-2-3-8(12)5-9/h2-6H,1H3,(H,13,15)
InChIKeyNHTKQMCFJHDNKA-UHFFFAOYSA-N
XLogP2.37
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.20
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3-fluorophenyl)-4-methyl-1,2-oxazole-3-carboxamide 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-(3-fluorophenyl)-3-methyl-1,2-oxazole-5-carboxamide
CID 16606648
4,5-difluoro-N-(3-fluorophenyl)-2-methylbenzamide
CID 686471
N-(3-fluorophenyl)-2,5-dimethylthiophene-3-carboxamide
CID 18196520
4-N-(3,4-dimethylphenyl)-1-N-(3-fluorophenyl)benzene-1,4-dicarboxamide
CID 109049648
4-chloro-N-(3-fluorophenyl)-1,5-dimethylpyrazole-3-carboxamide
CID 39853991
2,3,5,6-tetrafluoro-1-N,4-N-bis(3-fluorophenyl)benzene-1,4-dicarboxamide
CID 3094065
N-(3-fluorophenyl)-3-(4-methylphenyl)-1,2-oxazole-5-carboxamide
CID 46427554
(3-fluorophenyl)carbamic acid;hydrochloride
CID 70589934
4-N-(3-fluorophenyl)-1-N-(4-methylphenyl)benzene-1,4-dicarboxamide
CID 109049444
5-bromo-N-(3-fluorophenyl)-2-methylbenzamide
CID 65306774
3-N,5-N-bis(3-fluorophenyl)-1-methylpyrazole-3,5-dicarboxamide
CID 29097363
3,6-dichloro-N-(3-fluorophenyl)pyridine-2-carboxamide
CID 26719813

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-4-methyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(3-fluorophenyl)-4-methyl-1,2-oxazole-3-carboxamide (CID 110862667) is N-(3-fluorophenyl)-4-methyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(3-fluorophenyl)-4-methyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(3-fluorophenyl)-4-methyl-1,2-oxazole-3-carboxamide is Cc1conc1C(=O)Nc1cccc(F)c1.
What is the InChIKey of N-(3-fluorophenyl)-4-methyl-1,2-oxazole-3-carboxamide?
The InChIKey is NHTKQMCFJHDNKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN2O2/c1-7-6-16-14-10(7)11(15)13-9-4-2-3-8(12)5-9/h2-6H,1H3,(H,13,15).
What are the key properties of N-(3-fluorophenyl)-4-methyl-1,2-oxazole-3-carboxamide?
N-(3-fluorophenyl)-4-methyl-1,2-oxazole-3-carboxamide has a molecular weight of 220.20 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-4-methyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 110862667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).