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

C82H78F2N12O12 — CID 167659054

IUPACN-[3-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide
SMILESCCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncco3)cn2)c(C)c1.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncco3)cn2)c(F)c1.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncco3)nc2)c(C)c1.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncco3)nc2)c(F)c1
InChIInChI=1S/2C21H21N3O3.2C20H18FN3O3/c1-4-21(26)24(3)16-6-7-17(14(2)11-16)18-8-5-15(13-23-18)19(25)12-20-22-9-10-27-20;1-4-21(26)24(3)16-6-7-17(14(2)11-16)15-5-8-18(23-13-15)19(25)12-20-22-9-10-27-20;1-3-20(26)24(2)14-5-6-15(16(21)10-14)17-7-4-13(12-23-17)18(25)11-19-22-8-9-27-19;1-3-20(26)24(2)14-5-6-15(16(21)10-14)13-4-7-17(23-12-13)18(25)11-19-22-8-9-27-19/h2*5-11,13H,4,12H2,1-3H3;2*4-10,12H,3,11H2,1-2H3
InChIKeyRRPJKANMBNFWAW-UHFFFAOYSA-N
MW1461.59 g/mol
LogP15.03
Rot. Bonds24

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

N-[3-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide (PubChem CID 167659054) has the molecular formula C82H78F2N12O12 and a molecular weight of 1461.59 g/mol. Its IUPAC name is N-[3-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide.

Molecular Properties

Compound NameN-[3-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide
PubChem CID167659054
Molecular FormulaC82H78F2N12O12
Molecular Weight1461.59 g/mol
Exact Mass1460.58
IUPAC NameN-[3-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide
SMILESCCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncco3)cn2)c(C)c1.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncco3)cn2)c(F)c1.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncco3)nc2)c(C)c1.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncco3)nc2)c(F)c1
InChIInChI=1S/2C21H21N3O3.2C20H18FN3O3/c1-4-21(26)24(3)16-6-7-17(14(2)11-16)18-8-5-15(13-23-18)19(25)12-20-22-9-10-27-20;1-4-21(26)24(3)16-6-7-17(14(2)11-16)15-5-8-18(23-13-15)19(25)12-20-22-9-10-27-20;1-3-20(26)24(2)14-5-6-15(16(21)10-14)17-7-4-13(12-23-17)18(25)11-19-22-8-9-27-19;1-3-20(26)24(2)14-5-6-15(16(21)10-14)13-4-7-17(23-12-13)18(25)11-19-22-8-9-27-19/h2*5-11,13H,4,12H2,1-3H3;2*4-10,12H,3,11H2,1-2H3
InChIKeyRRPJKANMBNFWAW-UHFFFAOYSA-N
XLogP15.03
TPSA305.20 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds24
Heavy Atoms108
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001461.59
LogP ≤ 515.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Analyze N-[3-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(1,3-oxazol-2-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-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide?
The IUPAC name of N-[3-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide (CID 167659054) is N-[3-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide.
What is the SMILES notation for N-[3-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide?
The canonical SMILES for N-[3-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide is CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncco3)cn2)c(C)c1.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncco3)cn2)c(F)c1.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncco3)nc2)c(C)c1.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncco3)nc2)c(F)c1.
What is the InChIKey of N-[3-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide?
The InChIKey is RRPJKANMBNFWAW-UHFFFAOYSA-N. The full InChI is InChI=1S/2C21H21N3O3.2C20H18FN3O3/c1-4-21(26)24(3)16-6-7-17(14(2)11-16)18-8-5-15(13-23-18)19(25)12-20-22-9-10-27-20;1-4-21(26)24(3)16-6-7-17(14(2)11-16)15-5-8-18(23-13-15)19(25)12-20-22-9-10-27-20;1-3-20(26)24(2)14-5-6-15(16(21)10-14)17-7-4-13(12-23-17)18(25)11-19-22-8-9-27-19;1-3-20(26)24(2)14-5-6-15(16(21)10-14)13-4-7-17(23-12-13)18(25)11-19-22-8-9-27-19/h2*5-11,13H,4,12H2,1-3H3;2*4-10,12H,3,11H2,1-2H3.
What are the key properties of N-[3-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide?
N-[3-fluoro-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide has a molecular weight of 1461.59 g/mol, XLogP of 15.03, 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-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide;N-[3-fluoro-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]-N-methylpropanamide;N-methyl-N-[3-methyl-4-[5-[2-(1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]propanamide;N-methyl-N-[3-methyl-4-[6-[2-(1,3-oxazol-2-yl)acetyl]-3-pyridinyl]phenyl]propanamide is sourced from PubChem (CID 167659054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).