2-(2-fluorophenyl)-N-(3-hydroxy-3-phenylpropyl)acetamide

C17H18FNO2 — CID 111472132

IUPAC2-(2-fluorophenyl)-N-(3-hydroxy-3-phenylpropyl)acetamide
SMILESO=C(Cc1ccccc1F)NCCC(O)c1ccccc1
InChIInChI=1S/C17H18FNO2/c18-15-9-5-4-8-14(15)12-17(21)19-11-10-16(20)13-6-2-1-3-7-13/h1-9,16,20H,10-12H2,(H,19,21)
InChIKeyHZKGOUGURJSBRD-UHFFFAOYSA-N
MW287.33 g/mol
LogP2.61
Rot. Bonds6

About 2-(2-fluorophenyl)-N-(3-hydroxy-3-phenylpropyl)acetamide

2-(2-fluorophenyl)-N-(3-hydroxy-3-phenylpropyl)acetamide (PubChem CID 111472132) has the molecular formula C17H18FNO2 and a molecular weight of 287.33 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-N-(3-hydroxy-3-phenylpropyl)acetamide.

Molecular Properties

Compound Name2-(2-fluorophenyl)-N-(3-hydroxy-3-phenylpropyl)acetamide
PubChem CID111472132
Molecular FormulaC17H18FNO2
Molecular Weight287.33 g/mol
Exact Mass287.13
IUPAC Name2-(2-fluorophenyl)-N-(3-hydroxy-3-phenylpropyl)acetamide
SMILESO=C(Cc1ccccc1F)NCCC(O)c1ccccc1
InChIInChI=1S/C17H18FNO2/c18-15-9-5-4-8-14(15)12-17(21)19-11-10-16(20)13-6-2-1-3-7-13/h1-9,16,20H,10-12H2,(H,19,21)
InChIKeyHZKGOUGURJSBRD-UHFFFAOYSA-N
XLogP2.61
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.33
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(2-fluorophenyl)methylamino]-1-phenylpropan-1-ol
CID 12951841
5-chloro-2-fluoro-N-(3-hydroxy-3-phenylpropyl)benzamide
CID 111471543
2-(2-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]acetamide
CID 78792118
2-(3-hydroxyphenyl)-N-[(3S)-3-hydroxy-3-phenylpropyl]acetamide
CID 97014799
2,4,5-trifluoro-3-hydroxy-N-[(3R)-3-hydroxy-3-phenylpropyl]benzamide
CID 99854560
2-fluoro-N-[3-(4-fluorophenyl)-3-hydroxypropyl]benzamide
CID 110665726
N-(3-hydroxy-3-phenylpropyl)-2-(4-methoxyphenyl)acetamide
CID 71690034
N-(3-hydroxy-3-phenylpropyl)butanamide;propane
CID 143470750
N-ethyl-N'-(3-hydroxy-3-phenylpropyl)butanediamide
CID 111472033
N-(3-hydroxy-3-phenylpropyl)-2-phenylsulfanylacetamide
CID 111471528
N-(3-hydroxy-3-phenylpropyl)acetamide
CID 67579721
2-[[2-(2-fluorophenyl)acetyl]amino]acetic acid
CID 16785853

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-N-(3-hydroxy-3-phenylpropyl)acetamide?
The IUPAC name of 2-(2-fluorophenyl)-N-(3-hydroxy-3-phenylpropyl)acetamide (CID 111472132) is 2-(2-fluorophenyl)-N-(3-hydroxy-3-phenylpropyl)acetamide.
What is the SMILES notation for 2-(2-fluorophenyl)-N-(3-hydroxy-3-phenylpropyl)acetamide?
The canonical SMILES for 2-(2-fluorophenyl)-N-(3-hydroxy-3-phenylpropyl)acetamide is O=C(Cc1ccccc1F)NCCC(O)c1ccccc1.
What is the InChIKey of 2-(2-fluorophenyl)-N-(3-hydroxy-3-phenylpropyl)acetamide?
The InChIKey is HZKGOUGURJSBRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO2/c18-15-9-5-4-8-14(15)12-17(21)19-11-10-16(20)13-6-2-1-3-7-13/h1-9,16,20H,10-12H2,(H,19,21).
What are the key properties of 2-(2-fluorophenyl)-N-(3-hydroxy-3-phenylpropyl)acetamide?
2-(2-fluorophenyl)-N-(3-hydroxy-3-phenylpropyl)acetamide has a molecular weight of 287.33 g/mol, XLogP of 2.61, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-N-(3-hydroxy-3-phenylpropyl)acetamide is sourced from PubChem (CID 111472132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).