N-(2,6-difluorophenyl)-2-methyl-4-propan-2-yl-1,3-oxazole-5-carboxamide

C14H14F2N2O2 — CID 110684790

IUPACN-(2,6-difluorophenyl)-2-methyl-4-propan-2-yl-1,3-oxazole-5-carboxamide
SMILESCc1nc(C(C)C)c(C(=O)Nc2c(F)cccc2F)o1
InChIInChI=1S/C14H14F2N2O2/c1-7(2)11-13(20-8(3)17-11)14(19)18-12-9(15)5-4-6-10(12)16/h4-7H,1-3H3,(H,18,19)
InChIKeyAPKFVOCFXAPPHO-UHFFFAOYSA-N
MW280.27 g/mol
LogP3.64
Rot. Bonds3

About N-(2,6-difluorophenyl)-2-methyl-4-propan-2-yl-1,3-oxazole-5-carboxamide

N-(2,6-difluorophenyl)-2-methyl-4-propan-2-yl-1,3-oxazole-5-carboxamide (PubChem CID 110684790) has the molecular formula C14H14F2N2O2 and a molecular weight of 280.27 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)-2-methyl-4-propan-2-yl-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)-2-methyl-4-propan-2-yl-1,3-oxazole-5-carboxamide
PubChem CID110684790
Molecular FormulaC14H14F2N2O2
Molecular Weight280.27 g/mol
Exact Mass280.10
IUPAC NameN-(2,6-difluorophenyl)-2-methyl-4-propan-2-yl-1,3-oxazole-5-carboxamide
SMILESCc1nc(C(C)C)c(C(=O)Nc2c(F)cccc2F)o1
InChIInChI=1S/C14H14F2N2O2/c1-7(2)11-13(20-8(3)17-11)14(19)18-12-9(15)5-4-6-10(12)16/h4-7H,1-3H3,(H,18,19)
InChIKeyAPKFVOCFXAPPHO-UHFFFAOYSA-N
XLogP3.64
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.27
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2,6-difluorophenyl)-2-methyl-4-propan-2-yl-1,3-oxazole-5-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

2-methyl-4-propan-2-yl-N-pyrimidin-2-yl-1,3-oxazole-5-carboxamide
CID 110684765
2-methyl-4-propan-2-yl-N-(4-propan-2-yloxyphenyl)-1,3-oxazole-5-carboxamide
CID 110684741
N-[4-(dimethylamino)phenyl]-2-methyl-4-propan-2-yl-1,3-oxazole-5-carboxamide
CID 110684758
N-(2,6-difluorophenyl)-5-methyl-1,3,4-oxadiazole-2-carboxamide
CID 110392971
2-methyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-4-propan-2-yl-1,3-oxazole-5-carboxamide
CID 110684763
N-(3,4-dimethoxyphenyl)-2-methyl-4-propan-2-yl-1,3-oxazole-5-carboxamide
CID 110684744
N-(3-chloro-4-methoxyphenyl)-2-methyl-4-propan-2-yl-1,3-oxazole-5-carboxamide
CID 110684731
2-methyl-4-propan-2-yl-N-prop-2-enyl-1,3-oxazole-5-carboxamide
CID 110684617
N-(2,6-dimethylphenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 7113442
ethyl 2-(2,6-difluorophenyl)-4-propan-2-yl-1,3-oxazole-5-carboxylate
CID 114371360
N-(2,6-difluorophenyl)-2,5-dimethyl-1,3-thiazole-4-carboxamide
CID 110465586
4-amino-N-(2,6-difluorophenyl)-2-(propan-2-ylamino)-1,3-thiazole-5-carboxamide
CID 116669233

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)-2-methyl-4-propan-2-yl-1,3-oxazole-5-carboxamide?
The IUPAC name of N-(2,6-difluorophenyl)-2-methyl-4-propan-2-yl-1,3-oxazole-5-carboxamide (CID 110684790) is N-(2,6-difluorophenyl)-2-methyl-4-propan-2-yl-1,3-oxazole-5-carboxamide.
What is the SMILES notation for N-(2,6-difluorophenyl)-2-methyl-4-propan-2-yl-1,3-oxazole-5-carboxamide?
The canonical SMILES for N-(2,6-difluorophenyl)-2-methyl-4-propan-2-yl-1,3-oxazole-5-carboxamide is Cc1nc(C(C)C)c(C(=O)Nc2c(F)cccc2F)o1.
What is the InChIKey of N-(2,6-difluorophenyl)-2-methyl-4-propan-2-yl-1,3-oxazole-5-carboxamide?
The InChIKey is APKFVOCFXAPPHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F2N2O2/c1-7(2)11-13(20-8(3)17-11)14(19)18-12-9(15)5-4-6-10(12)16/h4-7H,1-3H3,(H,18,19).
What are the key properties of N-(2,6-difluorophenyl)-2-methyl-4-propan-2-yl-1,3-oxazole-5-carboxamide?
N-(2,6-difluorophenyl)-2-methyl-4-propan-2-yl-1,3-oxazole-5-carboxamide has a molecular weight of 280.27 g/mol, XLogP of 3.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)-2-methyl-4-propan-2-yl-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 110684790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).