N-cyclopropyl-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide

C14H12F2N2O2 — CID 53015634

IUPACN-cyclopropyl-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
SMILESCc1onc(-c2ccc(F)cc2F)c1C(=O)NC1CC1
InChIInChI=1S/C14H12F2N2O2/c1-7-12(14(19)17-9-3-4-9)13(18-20-7)10-5-2-8(15)6-11(10)16/h2,5-6,9H,3-4H2,1H3,(H,17,19)
InChIKeyJLOFMFYVEDPPKY-UHFFFAOYSA-N
MW278.26 g/mol
LogP2.82
Rot. Bonds3

About N-cyclopropyl-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide

N-cyclopropyl-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide (PubChem CID 53015634) has the molecular formula C14H12F2N2O2 and a molecular weight of 278.26 g/mol. Its IUPAC name is N-cyclopropyl-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
PubChem CID53015634
Molecular FormulaC14H12F2N2O2
Molecular Weight278.26 g/mol
Exact Mass278.09
IUPAC NameN-cyclopropyl-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
SMILESCc1onc(-c2ccc(F)cc2F)c1C(=O)NC1CC1
InChIInChI=1S/C14H12F2N2O2/c1-7-12(14(19)17-9-3-4-9)13(18-20-7)10-5-2-8(15)6-11(10)16/h2,5-6,9H,3-4H2,1H3,(H,17,19)
InChIKeyJLOFMFYVEDPPKY-UHFFFAOYSA-N
XLogP2.82
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.26
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclopropyl-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide?
The IUPAC name of N-cyclopropyl-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide (CID 53015634) is N-cyclopropyl-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide?
The canonical SMILES for N-cyclopropyl-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide is Cc1onc(-c2ccc(F)cc2F)c1C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide?
The InChIKey is JLOFMFYVEDPPKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F2N2O2/c1-7-12(14(19)17-9-3-4-9)13(18-20-7)10-5-2-8(15)6-11(10)16/h2,5-6,9H,3-4H2,1H3,(H,17,19).
What are the key properties of N-cyclopropyl-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide?
N-cyclopropyl-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide has a molecular weight of 278.26 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(2,4-difluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 53015634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).