N-[3-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide

C86H86F2N12O12 — CID 167538670

IUPACN-[3-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide
SMILESCCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cc(C)no3)cn2)c(C)c1.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cc(C)no3)cn2)c(F)c1.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cc(C)no3)nc2)c(C)c1.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cc(C)no3)nc2)c(F)c1
InChIInChI=1S/2C22H23N3O3.2C21H20FN3O3/c1-5-22(27)25(4)17-7-8-19(14(2)10-17)20-9-6-16(13-23-20)21(26)12-18-11-15(3)24-28-18;1-5-22(27)25(4)17-7-8-19(14(2)10-17)16-6-9-20(23-13-16)21(26)12-18-11-15(3)24-28-18;1-4-21(27)25(3)15-6-7-17(18(22)10-15)19-8-5-14(12-23-19)20(26)11-16-9-13(2)24-28-16;1-4-21(27)25(3)15-6-7-17(18(22)10-15)14-5-8-19(23-12-14)20(26)11-16-9-13(2)24-28-16/h2*6-11,13H,5,12H2,1-4H3;2*5-10,12H,4,11H2,1-3H3
InChIKeyAWOSTEAAWCHZEW-UHFFFAOYSA-N
MW1517.70 g/mol
LogP16.27
Rot. Bonds24

About N-[3-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide

N-[3-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide (PubChem CID 167538670) has the molecular formula C86H86F2N12O12 and a molecular weight of 1517.70 g/mol. Its IUPAC name is N-[3-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide.

Molecular Properties

Compound NameN-[3-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide
PubChem CID167538670
Molecular FormulaC86H86F2N12O12
Molecular Weight1517.70 g/mol
Exact Mass1516.65
IUPAC NameN-[3-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide
SMILESCCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cc(C)no3)cn2)c(C)c1.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cc(C)no3)cn2)c(F)c1.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cc(C)no3)nc2)c(C)c1.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cc(C)no3)nc2)c(F)c1
InChIInChI=1S/2C22H23N3O3.2C21H20FN3O3/c1-5-22(27)25(4)17-7-8-19(14(2)10-17)20-9-6-16(13-23-20)21(26)12-18-11-15(3)24-28-18;1-5-22(27)25(4)17-7-8-19(14(2)10-17)16-6-9-20(23-13-16)21(26)12-18-11-15(3)24-28-18;1-4-21(27)25(3)15-6-7-17(18(22)10-15)19-8-5-14(12-23-19)20(26)11-16-9-13(2)24-28-16;1-4-21(27)25(3)15-6-7-17(18(22)10-15)14-5-8-19(23-12-14)20(26)11-16-9-13(2)24-28-16/h2*6-11,13H,5,12H2,1-4H3;2*5-10,12H,4,11H2,1-3H3
InChIKeyAWOSTEAAWCHZEW-UHFFFAOYSA-N
XLogP16.27
TPSA305.20 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds24
Heavy Atoms112
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001517.70
LogP ≤ 516.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Analyze N-[3-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[3-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide?
The IUPAC name of N-[3-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide (CID 167538670) is N-[3-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide.
What is the SMILES notation for N-[3-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide?
The canonical SMILES for N-[3-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide is CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cc(C)no3)cn2)c(C)c1.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cc(C)no3)cn2)c(F)c1.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cc(C)no3)nc2)c(C)c1.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3cc(C)no3)nc2)c(F)c1.
What is the InChIKey of N-[3-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide?
The InChIKey is AWOSTEAAWCHZEW-UHFFFAOYSA-N. The full InChI is InChI=1S/2C22H23N3O3.2C21H20FN3O3/c1-5-22(27)25(4)17-7-8-19(14(2)10-17)20-9-6-16(13-23-20)21(26)12-18-11-15(3)24-28-18;1-5-22(27)25(4)17-7-8-19(14(2)10-17)16-6-9-20(23-13-16)21(26)12-18-11-15(3)24-28-18;1-4-21(27)25(3)15-6-7-17(18(22)10-15)19-8-5-14(12-23-19)20(26)11-16-9-13(2)24-28-16;1-4-21(27)25(3)15-6-7-17(18(22)10-15)14-5-8-19(23-12-14)20(26)11-16-9-13(2)24-28-16/h2*6-11,13H,5,12H2,1-4H3;2*5-10,12H,4,11H2,1-3H3.
What are the key properties of N-[3-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide?
N-[3-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide has a molecular weight of 1517.70 g/mol, XLogP of 16.27, 24 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-fluoro-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(3-methyl-1,2-oxazol-5-yl)acetyl]-3-pyridinyl]phenyl]propanamide is sourced from PubChem (CID 167538670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).