N-[(2-fluorophenyl)methyl]-3-(2-hydroxyphenyl)propanamide

C16H16FNO2 — CID 8571246

IUPACN-[(2-fluorophenyl)methyl]-3-(2-hydroxyphenyl)propanamide
SMILESO=C(CCc1ccccc1O)NCc1ccccc1F
InChIInChI=1S/C16H16FNO2/c17-14-7-3-1-6-13(14)11-18-16(20)10-9-12-5-2-4-8-15(12)19/h1-8,19H,9-11H2,(H,18,20)
InChIKeyVGDSVTIFZCTFLA-UHFFFAOYSA-N
MW273.31 g/mol
LogP2.78
Rot. Bonds5

About N-[(2-fluorophenyl)methyl]-3-(2-hydroxyphenyl)propanamide

N-[(2-fluorophenyl)methyl]-3-(2-hydroxyphenyl)propanamide (PubChem CID 8571246) has the molecular formula C16H16FNO2 and a molecular weight of 273.31 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methyl]-3-(2-hydroxyphenyl)propanamide.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methyl]-3-(2-hydroxyphenyl)propanamide
PubChem CID8571246
Molecular FormulaC16H16FNO2
Molecular Weight273.31 g/mol
Exact Mass273.12
IUPAC NameN-[(2-fluorophenyl)methyl]-3-(2-hydroxyphenyl)propanamide
SMILESO=C(CCc1ccccc1O)NCc1ccccc1F
InChIInChI=1S/C16H16FNO2/c17-14-7-3-1-6-13(14)11-18-16(20)10-9-12-5-2-4-8-15(12)19/h1-8,19H,9-11H2,(H,18,20)
InChIKeyVGDSVTIFZCTFLA-UHFFFAOYSA-N
XLogP2.78
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.31
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[2-(hydroxymethyl)phenyl]methyl]-3-(2-hydroxyphenyl)propanamide
CID 110909074
N-[(2-fluorophenyl)methyl]-3-hydroxypropanamide
CID 115139087
N-[(2-fluorophenyl)methyl]-3-(2-methoxyphenyl)propanamide
CID 40600143
N-benzyl-3-(2-hydroxyphenyl)propanamide
CID 3438013
3-(4-chlorophenyl)-N-[(2-fluorophenyl)methyl]propanamide
CID 41499879
2-(2,3-difluorophenyl)-N-[(2-hydroxyphenyl)methyl]acetamide
CID 115687726
N-[(2-fluorophenyl)methyl]hexanamide
CID 17068300
3-(2-fluorophenyl)-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]propanamide
CID 31644779
N-[2-(2-fluorophenyl)ethyl]-2-(2-hydroxyphenyl)acetamide
CID 78990913
3-[2-(4-chlorophenyl)ethylamino]-N-[(2-fluorophenyl)methyl]propanamide
CID 109020705
N-[(2-fluorophenyl)methyl]-3-phenoxypropanamide
CID 110755454
N-[(2-fluorophenyl)methyl]-4-(methylamino)butanamide;hydrochloride
CID 119679682

Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methyl]-3-(2-hydroxyphenyl)propanamide?
The IUPAC name of N-[(2-fluorophenyl)methyl]-3-(2-hydroxyphenyl)propanamide (CID 8571246) is N-[(2-fluorophenyl)methyl]-3-(2-hydroxyphenyl)propanamide.
What is the SMILES notation for N-[(2-fluorophenyl)methyl]-3-(2-hydroxyphenyl)propanamide?
The canonical SMILES for N-[(2-fluorophenyl)methyl]-3-(2-hydroxyphenyl)propanamide is O=C(CCc1ccccc1O)NCc1ccccc1F.
What is the InChIKey of N-[(2-fluorophenyl)methyl]-3-(2-hydroxyphenyl)propanamide?
The InChIKey is VGDSVTIFZCTFLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO2/c17-14-7-3-1-6-13(14)11-18-16(20)10-9-12-5-2-4-8-15(12)19/h1-8,19H,9-11H2,(H,18,20).
What are the key properties of N-[(2-fluorophenyl)methyl]-3-(2-hydroxyphenyl)propanamide?
N-[(2-fluorophenyl)methyl]-3-(2-hydroxyphenyl)propanamide has a molecular weight of 273.31 g/mol, XLogP of 2.78, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluorophenyl)methyl]-3-(2-hydroxyphenyl)propanamide is sourced from PubChem (CID 8571246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).