3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)propanamide

C18H15FN4O2S — CID 134027897

IUPAC3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)propanamide
SMILESO=C(CCc1ncc(-c2ccc(F)cc2)o1)NCc1cn2ccsc2n1
InChIInChI=1S/C18H15FN4O2S/c19-13-3-1-12(2-4-13)15-10-21-17(25-15)6-5-16(24)20-9-14-11-23-7-8-26-18(23)22-14/h1-4,7-8,10-11H,5-6,9H2,(H,20,24)
InChIKeyGNOZTAKQHVZWGD-UHFFFAOYSA-N
MW370.41 g/mol
LogP3.44
Rot. Bonds6

About 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)propanamide

3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)propanamide (PubChem CID 134027897) has the molecular formula C18H15FN4O2S and a molecular weight of 370.41 g/mol. Its IUPAC name is 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)propanamide.

Molecular Properties

Compound Name3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)propanamide
PubChem CID134027897
Molecular FormulaC18H15FN4O2S
Molecular Weight370.41 g/mol
Exact Mass370.09
IUPAC Name3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)propanamide
SMILESO=C(CCc1ncc(-c2ccc(F)cc2)o1)NCc1cn2ccsc2n1
InChIInChI=1S/C18H15FN4O2S/c19-13-3-1-12(2-4-13)15-10-21-17(25-15)6-5-16(24)20-9-14-11-23-7-8-26-18(23)22-14/h1-4,7-8,10-11H,5-6,9H2,(H,20,24)
InChIKeyGNOZTAKQHVZWGD-UHFFFAOYSA-N
XLogP3.44
TPSA72.43 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(2-fluorophenyl)methyl]-3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]propanamide
CID 17493813
N-[2-[di(propan-2-yl)amino]ethyl]-3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]propanamide
CID 18160896
N-[(1-ethylbenzimidazol-2-yl)methyl]-3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]propanamide
CID 51312739
N-[2-(4-fluorophenyl)ethyl]-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide
CID 30698610
3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methyl-1,3-thiazol-2-ylidene)propanamide
CID 29473465
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-3-[5-[2-(4-methoxyphenyl)ethyl]-1,3,4-oxadiazol-2-yl]propanamide
CID 25274560
3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-[[4-(propan-2-yloxymethyl)phenyl]methyl]propanamide
CID 55748394
N'-(4,6-dimethylpyrimidin-2-yl)-3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]propanehydrazide
CID 30133076
N-[(2R)-2-(dimethylamino)-3-methylbutyl]-3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]propanamide
CID 30894313
N-[2-(dimethylamino)-3-methylbutyl]-3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]propanamide
CID 42940238
3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 16593744
N-[2-(2,4-dimethylphenyl)ethyl]-3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]propanamide
CID 48670903

Frequently Asked Questions

What is the IUPAC name of 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)propanamide?
The IUPAC name of 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)propanamide (CID 134027897) is 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)propanamide.
What is the SMILES notation for 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)propanamide?
The canonical SMILES for 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)propanamide is O=C(CCc1ncc(-c2ccc(F)cc2)o1)NCc1cn2ccsc2n1.
What is the InChIKey of 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)propanamide?
The InChIKey is GNOZTAKQHVZWGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN4O2S/c19-13-3-1-12(2-4-13)15-10-21-17(25-15)6-5-16(24)20-9-14-11-23-7-8-26-18(23)22-14/h1-4,7-8,10-11H,5-6,9H2,(H,20,24).
What are the key properties of 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)propanamide?
3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)propanamide has a molecular weight of 370.41 g/mol, XLogP of 3.44, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)propanamide is sourced from PubChem (CID 134027897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).