N-[(4-fluorophenyl)-pyridin-3-ylmethyl]-2-(4-hydroxyphenyl)acetamide

C20H17FN2O2 — CID 75380343

IUPACN-[(4-fluorophenyl)-pyridin-3-ylmethyl]-2-(4-hydroxyphenyl)acetamide
SMILESO=C(Cc1ccc(O)cc1)NC(c1ccc(F)cc1)c1cccnc1
InChIInChI=1S/C20H17FN2O2/c21-17-7-5-15(6-8-17)20(16-2-1-11-22-13-16)23-19(25)12-14-3-9-18(24)10-4-14/h1-11,13,20,24H,12H2,(H,23,25)
InChIKeyQMGOYFZKAGMAAY-UHFFFAOYSA-N
MW336.37 g/mol
LogP3.37
Rot. Bonds5

About N-[(4-fluorophenyl)-pyridin-3-ylmethyl]-2-(4-hydroxyphenyl)acetamide

N-[(4-fluorophenyl)-pyridin-3-ylmethyl]-2-(4-hydroxyphenyl)acetamide (PubChem CID 75380343) has the molecular formula C20H17FN2O2 and a molecular weight of 336.37 g/mol. Its IUPAC name is N-[(4-fluorophenyl)-pyridin-3-ylmethyl]-2-(4-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)-pyridin-3-ylmethyl]-2-(4-hydroxyphenyl)acetamide
PubChem CID75380343
Molecular FormulaC20H17FN2O2
Molecular Weight336.37 g/mol
Exact Mass336.13
IUPAC NameN-[(4-fluorophenyl)-pyridin-3-ylmethyl]-2-(4-hydroxyphenyl)acetamide
SMILESO=C(Cc1ccc(O)cc1)NC(c1ccc(F)cc1)c1cccnc1
InChIInChI=1S/C20H17FN2O2/c21-17-7-5-15(6-8-17)20(16-2-1-11-22-13-16)23-19(25)12-14-3-9-18(24)10-4-14/h1-11,13,20,24H,12H2,(H,23,25)
InChIKeyQMGOYFZKAGMAAY-UHFFFAOYSA-N
XLogP3.37
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.37
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-fluorophenyl)-pyridin-4-ylmethyl]-2-phenylacetamide
CID 110442330
N-[(S)-(4-fluorophenyl)-pyridin-3-ylmethyl]-2-(1-hydroxycyclohexyl)acetamide
CID 96568791
N-[(4-fluorophenyl)-pyridin-4-ylmethyl]-2-(4-methoxyphenyl)acetamide
CID 110440139
2-(4-chlorophenyl)-N-[(3,4-dimethylphenyl)-pyridin-3-ylmethyl]acetamide
CID 20897057
(1R)-1-(4-fluorophenyl)-N-methyl-1-pyridin-3-ylmethanamine
CID 51693922
2-(4-fluorophenyl)-N-[(R)-(3-methylphenyl)-phenylmethyl]acetamide
CID 100750032
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(R)-phenyl(pyridin-3-yl)methyl]acetamide
CID 99832422
2-(4-hydroxyphenyl)-N-[(1R)-3,3,3-trifluoro-1-(4-fluorophenyl)propyl]acetamide
CID 124573471
2-(4-methylphenyl)-N-(1-pyridin-3-ylethyl)acetamide
CID 18163057
(2S)-2-[[2-(4-fluorophenyl)acetyl]amino]-N-(pyridin-3-ylmethyl)propanamide
CID 110347875
2-(2-chlorophenyl)-N-[(4-fluorophenyl)-phenylmethyl]acetamide
CID 55583548
(1S)-2-(4-fluorophenyl)-1-pyridin-3-ylethanol
CID 93312266

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)-pyridin-3-ylmethyl]-2-(4-hydroxyphenyl)acetamide?
The IUPAC name of N-[(4-fluorophenyl)-pyridin-3-ylmethyl]-2-(4-hydroxyphenyl)acetamide (CID 75380343) is N-[(4-fluorophenyl)-pyridin-3-ylmethyl]-2-(4-hydroxyphenyl)acetamide.
What is the SMILES notation for N-[(4-fluorophenyl)-pyridin-3-ylmethyl]-2-(4-hydroxyphenyl)acetamide?
The canonical SMILES for N-[(4-fluorophenyl)-pyridin-3-ylmethyl]-2-(4-hydroxyphenyl)acetamide is O=C(Cc1ccc(O)cc1)NC(c1ccc(F)cc1)c1cccnc1.
What is the InChIKey of N-[(4-fluorophenyl)-pyridin-3-ylmethyl]-2-(4-hydroxyphenyl)acetamide?
The InChIKey is QMGOYFZKAGMAAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17FN2O2/c21-17-7-5-15(6-8-17)20(16-2-1-11-22-13-16)23-19(25)12-14-3-9-18(24)10-4-14/h1-11,13,20,24H,12H2,(H,23,25).
What are the key properties of N-[(4-fluorophenyl)-pyridin-3-ylmethyl]-2-(4-hydroxyphenyl)acetamide?
N-[(4-fluorophenyl)-pyridin-3-ylmethyl]-2-(4-hydroxyphenyl)acetamide has a molecular weight of 336.37 g/mol, XLogP of 3.37, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)-pyridin-3-ylmethyl]-2-(4-hydroxyphenyl)acetamide is sourced from PubChem (CID 75380343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).