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

C21H20FN3O3 — CID 167703263

IUPACN-[2-fluoro-4-[5-[2-(5-methyl-1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide
SMILESCCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncc(C)o3)cn2)cc1F
InChIInChI=1S/C21H20FN3O3/c1-4-21(27)25(3)18-8-6-14(9-16(18)22)17-7-5-15(12-23-17)19(26)10-20-24-11-13(2)28-20/h5-9,11-12H,4,10H2,1-3H3
InChIKeyDDQCOOCRUJEVAP-UHFFFAOYSA-N
MW381.41 g/mol
LogP3.98
Rot. Bonds6

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

N-[2-fluoro-4-[5-[2-(5-methyl-1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide (PubChem CID 167703263) has the molecular formula C21H20FN3O3 and a molecular weight of 381.41 g/mol. Its IUPAC name is N-[2-fluoro-4-[5-[2-(5-methyl-1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide.

Molecular Properties

Compound NameN-[2-fluoro-4-[5-[2-(5-methyl-1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide
PubChem CID167703263
Molecular FormulaC21H20FN3O3
Molecular Weight381.41 g/mol
Exact Mass381.15
IUPAC NameN-[2-fluoro-4-[5-[2-(5-methyl-1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide
SMILESCCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncc(C)o3)cn2)cc1F
InChIInChI=1S/C21H20FN3O3/c1-4-21(27)25(3)18-8-6-14(9-16(18)22)17-7-5-15(12-23-17)19(26)10-20-24-11-13(2)28-20/h5-9,11-12H,4,10H2,1-3H3
InChIKeyDDQCOOCRUJEVAP-UHFFFAOYSA-N
XLogP3.98
TPSA76.30 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.41
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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

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Related Compounds

7-(3-Fluorophenyl)-1-[5-(pyridin-2-yl)-1,3-oxazol-2-yl]heptan-1-one
CID 16735386
7-(2-Fluorophenyl)-1-[5-(pyridin-2-yl)-1,3-oxazol-2-yl]heptan-1-one
CID 16736627
7-(4-Fluorophenyl)-1-[5-(pyridin-2-yl)-1,3-oxazol-2-yl]heptan-1-one
CID 16736628
4-(Methyl(phenethyl)amino)-1-(5-(pyridin-2-yl)oxazol-2-yl)butan-1-one
CID 16738149
1-(5-(4-Fluoropyridin-2-yl)oxazol-2-yl)-7-phenylheptan-1-one
CID 16110654
Methyl 6-(2-(7-phenylheptanoyl)oxazol-5-yl)nicotinate
CID 16110713
N,N-diethyl-2-[4-[4-(5-ethyl-1,3-oxazol-2-yl)-2-fluorophenyl]piperazin-1-yl]-2-phenylacetamide
CID 58055783
6-[2-(7-Phenylheptanoyl)-1,3-oxazol-5-yl]pyridine-3-carboxamide
CID 16110659
2-[2-(7-Phenyl-heptyl)-oxazol-5-yl]-pyridine
CID 11267182
7-Phenyl-1-(2-(pyridin-2-yl)oxazol-5-yl)heptan-1-one
CID 24950840
N,N-Dimethyl-4-(5-phenyl-1,3-oxazol-2-yl)aniline
CID 15134379
Oxazole, 5-(4-fluorophenyl)-2-(3-pyridyl)-
CID 617616

Frequently Asked Questions

What is the IUPAC name of N-[2-fluoro-4-[5-[2-(5-methyl-1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide?
The IUPAC name of N-[2-fluoro-4-[5-[2-(5-methyl-1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide (CID 167703263) is N-[2-fluoro-4-[5-[2-(5-methyl-1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide.
What is the SMILES notation for N-[2-fluoro-4-[5-[2-(5-methyl-1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide?
The canonical SMILES for N-[2-fluoro-4-[5-[2-(5-methyl-1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide is CCC(=O)N(C)c1ccc(-c2ccc(C(=O)Cc3ncc(C)o3)cn2)cc1F.
What is the InChIKey of N-[2-fluoro-4-[5-[2-(5-methyl-1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide?
The InChIKey is DDQCOOCRUJEVAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20FN3O3/c1-4-21(27)25(3)18-8-6-14(9-16(18)22)17-7-5-15(12-23-17)19(26)10-20-24-11-13(2)28-20/h5-9,11-12H,4,10H2,1-3H3.
What are the key properties of N-[2-fluoro-4-[5-[2-(5-methyl-1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide?
N-[2-fluoro-4-[5-[2-(5-methyl-1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide has a molecular weight of 381.41 g/mol, XLogP of 3.98, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-fluoro-4-[5-[2-(5-methyl-1,3-oxazol-2-yl)acetyl]-2-pyridinyl]phenyl]-N-methylpropanamide is sourced from PubChem (CID 167703263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).