2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]-N-[4-(2-hydroxyethyl)phenyl]acetamide

C19H17FN2O2S — CID 42569825

IUPAC2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]-N-[4-(2-hydroxyethyl)phenyl]acetamide
SMILESO=C(Cc1cnc(-c2ccccc2F)s1)Nc1ccc(CCO)cc1
InChIInChI=1S/C19H17FN2O2S/c20-17-4-2-1-3-16(17)19-21-12-15(25-19)11-18(24)22-14-7-5-13(6-8-14)9-10-23/h1-8,12,23H,9-11H2,(H,22,24)
InChIKeyFATRVJPNTMDKLH-UHFFFAOYSA-N
MW356.42 g/mol
LogP3.67
Rot. Bonds6

About 2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]-N-[4-(2-hydroxyethyl)phenyl]acetamide

2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]-N-[4-(2-hydroxyethyl)phenyl]acetamide (PubChem CID 42569825) has the molecular formula C19H17FN2O2S and a molecular weight of 356.42 g/mol. Its IUPAC name is 2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]-N-[4-(2-hydroxyethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]-N-[4-(2-hydroxyethyl)phenyl]acetamide
PubChem CID42569825
Molecular FormulaC19H17FN2O2S
Molecular Weight356.42 g/mol
Exact Mass356.10
IUPAC Name2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]-N-[4-(2-hydroxyethyl)phenyl]acetamide
SMILESO=C(Cc1cnc(-c2ccccc2F)s1)Nc1ccc(CCO)cc1
InChIInChI=1S/C19H17FN2O2S/c20-17-4-2-1-3-16(17)19-21-12-15(25-19)11-18(24)22-14-7-5-13(6-8-14)9-10-23/h1-8,12,23H,9-11H2,(H,22,24)
InChIKeyFATRVJPNTMDKLH-UHFFFAOYSA-N
XLogP3.67
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]-N-[4-(2-hydroxyethyl)phenyl]acetamide?
The IUPAC name of 2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]-N-[4-(2-hydroxyethyl)phenyl]acetamide (CID 42569825) is 2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]-N-[4-(2-hydroxyethyl)phenyl]acetamide.
What is the SMILES notation for 2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]-N-[4-(2-hydroxyethyl)phenyl]acetamide?
The canonical SMILES for 2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]-N-[4-(2-hydroxyethyl)phenyl]acetamide is O=C(Cc1cnc(-c2ccccc2F)s1)Nc1ccc(CCO)cc1.
What is the InChIKey of 2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]-N-[4-(2-hydroxyethyl)phenyl]acetamide?
The InChIKey is FATRVJPNTMDKLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN2O2S/c20-17-4-2-1-3-16(17)19-21-12-15(25-19)11-18(24)22-14-7-5-13(6-8-14)9-10-23/h1-8,12,23H,9-11H2,(H,22,24).
What are the key properties of 2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]-N-[4-(2-hydroxyethyl)phenyl]acetamide?
2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]-N-[4-(2-hydroxyethyl)phenyl]acetamide has a molecular weight of 356.42 g/mol, XLogP of 3.67, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-fluorophenyl)-1,3-thiazol-5-yl]-N-[4-(2-hydroxyethyl)phenyl]acetamide is sourced from PubChem (CID 42569825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).