N-(3,4-difluorophenyl)-2-(4-methyl-2-phenyl-1,3-oxazol-5-yl)acetamide

C18H14F2N2O2 — CID 110651460

IUPACN-(3,4-difluorophenyl)-2-(4-methyl-2-phenyl-1,3-oxazol-5-yl)acetamide
SMILESCc1nc(-c2ccccc2)oc1CC(=O)Nc1ccc(F)c(F)c1
InChIInChI=1S/C18H14F2N2O2/c1-11-16(24-18(21-11)12-5-3-2-4-6-12)10-17(23)22-13-7-8-14(19)15(20)9-13/h2-9H,10H2,1H3,(H,22,23)
InChIKeyAVHNDKKXQPAHMY-UHFFFAOYSA-N
MW328.32 g/mol
LogP4.11
Rot. Bonds4

About N-(3,4-difluorophenyl)-2-(4-methyl-2-phenyl-1,3-oxazol-5-yl)acetamide

N-(3,4-difluorophenyl)-2-(4-methyl-2-phenyl-1,3-oxazol-5-yl)acetamide (PubChem CID 110651460) has the molecular formula C18H14F2N2O2 and a molecular weight of 328.32 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-2-(4-methyl-2-phenyl-1,3-oxazol-5-yl)acetamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-2-(4-methyl-2-phenyl-1,3-oxazol-5-yl)acetamide
PubChem CID110651460
Molecular FormulaC18H14F2N2O2
Molecular Weight328.32 g/mol
Exact Mass328.10
IUPAC NameN-(3,4-difluorophenyl)-2-(4-methyl-2-phenyl-1,3-oxazol-5-yl)acetamide
SMILESCc1nc(-c2ccccc2)oc1CC(=O)Nc1ccc(F)c(F)c1
InChIInChI=1S/C18H14F2N2O2/c1-11-16(24-18(21-11)12-5-3-2-4-6-12)10-17(23)22-13-7-8-14(19)15(20)9-13/h2-9H,10H2,1H3,(H,22,23)
InChIKeyAVHNDKKXQPAHMY-UHFFFAOYSA-N
XLogP4.11
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.32
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-2-(4-methyl-2-phenyl-1,3-oxazol-5-yl)acetamide?
The IUPAC name of N-(3,4-difluorophenyl)-2-(4-methyl-2-phenyl-1,3-oxazol-5-yl)acetamide (CID 110651460) is N-(3,4-difluorophenyl)-2-(4-methyl-2-phenyl-1,3-oxazol-5-yl)acetamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-2-(4-methyl-2-phenyl-1,3-oxazol-5-yl)acetamide?
The canonical SMILES for N-(3,4-difluorophenyl)-2-(4-methyl-2-phenyl-1,3-oxazol-5-yl)acetamide is Cc1nc(-c2ccccc2)oc1CC(=O)Nc1ccc(F)c(F)c1.
What is the InChIKey of N-(3,4-difluorophenyl)-2-(4-methyl-2-phenyl-1,3-oxazol-5-yl)acetamide?
The InChIKey is AVHNDKKXQPAHMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14F2N2O2/c1-11-16(24-18(21-11)12-5-3-2-4-6-12)10-17(23)22-13-7-8-14(19)15(20)9-13/h2-9H,10H2,1H3,(H,22,23).
What are the key properties of N-(3,4-difluorophenyl)-2-(4-methyl-2-phenyl-1,3-oxazol-5-yl)acetamide?
N-(3,4-difluorophenyl)-2-(4-methyl-2-phenyl-1,3-oxazol-5-yl)acetamide has a molecular weight of 328.32 g/mol, XLogP of 4.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-2-(4-methyl-2-phenyl-1,3-oxazol-5-yl)acetamide is sourced from PubChem (CID 110651460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).