2-(3-fluoroanilino)-N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]acetamide

C19H23FN2O3 — CID 71968998

IUPAC2-(3-fluoroanilino)-N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]acetamide
SMILESCC(C)Oc1ccc(C(O)CNC(=O)CNc2cccc(F)c2)cc1
InChIInChI=1S/C19H23FN2O3/c1-13(2)25-17-8-6-14(7-9-17)18(23)11-22-19(24)12-21-16-5-3-4-15(20)10-16/h3-10,13,18,21,23H,11-12H2,1-2H3,(H,22,24)
InChIKeyZXLGQNINBYHQIW-UHFFFAOYSA-N
MW346.40 g/mol
LogP2.87
Rot. Bonds8

About 2-(3-fluoroanilino)-N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]acetamide

2-(3-fluoroanilino)-N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]acetamide (PubChem CID 71968998) has the molecular formula C19H23FN2O3 and a molecular weight of 346.40 g/mol. Its IUPAC name is 2-(3-fluoroanilino)-N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(3-fluoroanilino)-N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]acetamide
PubChem CID71968998
Molecular FormulaC19H23FN2O3
Molecular Weight346.40 g/mol
Exact Mass346.17
IUPAC Name2-(3-fluoroanilino)-N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]acetamide
SMILESCC(C)Oc1ccc(C(O)CNC(=O)CNc2cccc(F)c2)cc1
InChIInChI=1S/C19H23FN2O3/c1-13(2)25-17-8-6-14(7-9-17)18(23)11-22-19(24)12-21-16-5-3-4-15(20)10-16/h3-10,13,18,21,23H,11-12H2,1-2H3,(H,22,24)
InChIKeyZXLGQNINBYHQIW-UHFFFAOYSA-N
XLogP2.87
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.40
LogP ≤ 52.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-(3-fluoroanilino)-N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-fluoroanilino)-N-[(2R)-2-hydroxy-2-(3-propan-2-yloxyphenyl)ethyl]acetamide
CID 97227834
2-[(3-fluorophenyl)methylamino]-1-(4-propan-2-yloxyphenyl)ethanol
CID 111422221
2-(3-chlorophenyl)-N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]acetamide
CID 111422677
2-amino-N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]acetamide;hydrochloride
CID 119328681
2-(3-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 54829870
3-fluoro-N-[(4-propan-2-yloxyphenyl)methyl]aniline
CID 39360354
2-(3-fluorophenyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide
CID 134045512
N-[4-(difluoromethoxy)phenyl]-2-(3-fluoroanilino)acetamide
CID 9098936
2-(3-fluoroanilino)-N-(2-propan-2-yloxyphenyl)acetamide
CID 39426142
N-[2-[[N-ethyl-N'-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]carbamimidoyl]amino]ethyl]-2-(3-fluorophenyl)acetamide
CID 109493733
N-[2-(3-fluorophenyl)-2-hydroxyethyl]-2-(methylamino)acetamide
CID 119755074
2-(3-methylanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 39419759

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoroanilino)-N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]acetamide?
The IUPAC name of 2-(3-fluoroanilino)-N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]acetamide (CID 71968998) is 2-(3-fluoroanilino)-N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(3-fluoroanilino)-N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]acetamide?
The canonical SMILES for 2-(3-fluoroanilino)-N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]acetamide is CC(C)Oc1ccc(C(O)CNC(=O)CNc2cccc(F)c2)cc1.
What is the InChIKey of 2-(3-fluoroanilino)-N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]acetamide?
The InChIKey is ZXLGQNINBYHQIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O3/c1-13(2)25-17-8-6-14(7-9-17)18(23)11-22-19(24)12-21-16-5-3-4-15(20)10-16/h3-10,13,18,21,23H,11-12H2,1-2H3,(H,22,24).
What are the key properties of 2-(3-fluoroanilino)-N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]acetamide?
2-(3-fluoroanilino)-N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]acetamide has a molecular weight of 346.40 g/mol, XLogP of 2.87, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoroanilino)-N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]acetamide is sourced from PubChem (CID 71968998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).