2-(5-fluoro-2-pyridinyl)-N-[(2S)-1-hydroxy-3-(4-hydroxyphenyl)propan-2-yl]acetamide

C16H17FN2O3 — CID 172894530

IUPAC2-(5-fluoro-2-pyridinyl)-N-[(2S)-1-hydroxy-3-(4-hydroxyphenyl)propan-2-yl]acetamide
SMILESO=C(Cc1ccc(F)cn1)N[C@H](CO)Cc1ccc(O)cc1
InChIInChI=1S/C16H17FN2O3/c17-12-3-4-13(18-9-12)8-16(22)19-14(10-20)7-11-1-5-15(21)6-2-11/h1-6,9,14,20-21H,7-8,10H2,(H,19,22)/t14-/m0/s1
InChIKeyHLDCVKPTIJWEFK-AWEZNQCLSA-N
MW304.32 g/mol
LogP1.19
Rot. Bonds6

About 2-(5-fluoro-2-pyridinyl)-N-[(2S)-1-hydroxy-3-(4-hydroxyphenyl)propan-2-yl]acetamide

2-(5-fluoro-2-pyridinyl)-N-[(2S)-1-hydroxy-3-(4-hydroxyphenyl)propan-2-yl]acetamide (PubChem CID 172894530) has the molecular formula C16H17FN2O3 and a molecular weight of 304.32 g/mol. Its IUPAC name is 2-(5-fluoro-2-pyridinyl)-N-[(2S)-1-hydroxy-3-(4-hydroxyphenyl)propan-2-yl]acetamide.

Molecular Properties

Compound Name2-(5-fluoro-2-pyridinyl)-N-[(2S)-1-hydroxy-3-(4-hydroxyphenyl)propan-2-yl]acetamide
PubChem CID172894530
Molecular FormulaC16H17FN2O3
Molecular Weight304.32 g/mol
Exact Mass304.12
IUPAC Name2-(5-fluoro-2-pyridinyl)-N-[(2S)-1-hydroxy-3-(4-hydroxyphenyl)propan-2-yl]acetamide
SMILESO=C(Cc1ccc(F)cn1)N[C@H](CO)Cc1ccc(O)cc1
InChIInChI=1S/C16H17FN2O3/c17-12-3-4-13(18-9-12)8-16(22)19-14(10-20)7-11-1-5-15(21)6-2-11/h1-6,9,14,20-21H,7-8,10H2,(H,19,22)/t14-/m0/s1
InChIKeyHLDCVKPTIJWEFK-AWEZNQCLSA-N
XLogP1.19
TPSA82.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.32
LogP ≤ 51.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-(5-fluoro-2-pyridinyl)-N-[(2S)-1-hydroxy-3-(4-hydroxyphenyl)propan-2-yl]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

5-fluoro-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]pyridine-2-carboxamide
CID 102673867
(2S)-2-amino-N-(5-fluoro-2-pyridinyl)-3-(4-hydroxyphenyl)propanamide
CID 65482263
N-[1-(4-fluorophenyl)-3-hydroxypropan-2-yl]-3-hydroxypyridine-2-carboxamide
CID 122145854
4-chloro-2,5-difluoro-N-[(2S)-1-hydroxy-3-(4-hydroxyphenyl)propan-2-yl]benzamide
CID 122147380
N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-pyridin-3-ylacetamide
CID 102673691
N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]-2-(2,4,5-trifluorophenyl)acetamide
CID 99780548
1-(4-chlorophenyl)-3-[1-(4-fluorophenyl)-3-hydroxypropan-2-yl]urea
CID 135238903
4-(5-fluoro-2-pyridinyl)-3-oxobutanoic acid
CID 175834373
benzyl N-[1-(4-fluorophenyl)-3-hydroxypropan-2-yl]carbamate
CID 85273603
N-[(2R)-1-(4-fluorophenyl)-3-hydroxypropan-2-yl]-4-(2-methylphenoxy)butanamide
CID 99780561
N-[1-(2,4-difluorophenyl)ethyl]-2-(4-hydroxyphenyl)acetamide
CID 78806063
4-[3-hydroxy-2-(iodoamino)propyl]phenol
CID 88639035

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-2-pyridinyl)-N-[(2S)-1-hydroxy-3-(4-hydroxyphenyl)propan-2-yl]acetamide?
The IUPAC name of 2-(5-fluoro-2-pyridinyl)-N-[(2S)-1-hydroxy-3-(4-hydroxyphenyl)propan-2-yl]acetamide (CID 172894530) is 2-(5-fluoro-2-pyridinyl)-N-[(2S)-1-hydroxy-3-(4-hydroxyphenyl)propan-2-yl]acetamide.
What is the SMILES notation for 2-(5-fluoro-2-pyridinyl)-N-[(2S)-1-hydroxy-3-(4-hydroxyphenyl)propan-2-yl]acetamide?
The canonical SMILES for 2-(5-fluoro-2-pyridinyl)-N-[(2S)-1-hydroxy-3-(4-hydroxyphenyl)propan-2-yl]acetamide is O=C(Cc1ccc(F)cn1)N[C@H](CO)Cc1ccc(O)cc1.
What is the InChIKey of 2-(5-fluoro-2-pyridinyl)-N-[(2S)-1-hydroxy-3-(4-hydroxyphenyl)propan-2-yl]acetamide?
The InChIKey is HLDCVKPTIJWEFK-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H17FN2O3/c17-12-3-4-13(18-9-12)8-16(22)19-14(10-20)7-11-1-5-15(21)6-2-11/h1-6,9,14,20-21H,7-8,10H2,(H,19,22)/t14-/m0/s1.
What are the key properties of 2-(5-fluoro-2-pyridinyl)-N-[(2S)-1-hydroxy-3-(4-hydroxyphenyl)propan-2-yl]acetamide?
2-(5-fluoro-2-pyridinyl)-N-[(2S)-1-hydroxy-3-(4-hydroxyphenyl)propan-2-yl]acetamide has a molecular weight of 304.32 g/mol, XLogP of 1.19, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-2-pyridinyl)-N-[(2S)-1-hydroxy-3-(4-hydroxyphenyl)propan-2-yl]acetamide is sourced from PubChem (CID 172894530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).