2,6-difluoro-N-(2-hydroxy-2-naphthalen-2-ylethyl)benzamide

C19H15F2NO2 — CID 3544778

IUPAC2,6-difluoro-N-(2-hydroxy-2-naphthalen-2-ylethyl)benzamide
SMILESO=C(NCC(O)c1ccc2ccccc2c1)c1c(F)cccc1F
InChIInChI=1S/C19H15F2NO2/c20-15-6-3-7-16(21)18(15)19(24)22-11-17(23)14-9-8-12-4-1-2-5-13(12)10-14/h1-10,17,23H,11H2,(H,22,24)
InChIKeyAIYDWERSTIWQPX-UHFFFAOYSA-N
MW327.33 g/mol
LogP3.58
Rot. Bonds4

About 2,6-difluoro-N-(2-hydroxy-2-naphthalen-2-ylethyl)benzamide

2,6-difluoro-N-(2-hydroxy-2-naphthalen-2-ylethyl)benzamide (PubChem CID 3544778) has the molecular formula C19H15F2NO2 and a molecular weight of 327.33 g/mol. Its IUPAC name is 2,6-difluoro-N-(2-hydroxy-2-naphthalen-2-ylethyl)benzamide.

Molecular Properties

Compound Name2,6-difluoro-N-(2-hydroxy-2-naphthalen-2-ylethyl)benzamide
PubChem CID3544778
Molecular FormulaC19H15F2NO2
Molecular Weight327.33 g/mol
Exact Mass327.11
IUPAC Name2,6-difluoro-N-(2-hydroxy-2-naphthalen-2-ylethyl)benzamide
SMILESO=C(NCC(O)c1ccc2ccccc2c1)c1c(F)cccc1F
InChIInChI=1S/C19H15F2NO2/c20-15-6-3-7-16(21)18(15)19(24)22-11-17(23)14-9-8-12-4-1-2-5-13(12)10-14/h1-10,17,23H,11H2,(H,22,24)
InChIKeyAIYDWERSTIWQPX-UHFFFAOYSA-N
XLogP3.58
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.33
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2,6-difluoro-N-(2-hydroxy-2-naphthalen-2-ylethyl)benzamide 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

N-[2-[[(1S,2S)-3-[(2,4-dimethylphenyl)methylamino]-1-hydroxy-1-phenylpropan-2-yl]amino]-2-oxoethyl]-3-(trifluoromethyl)benzamide
CID 10186010
4-[2-(Hydroxymethyl)naphthalen-1-Yl]-N-[2-(Morpholin-4-Yl)ethyl]benzamide
CID 60196237
6-[2-(Hydroxymethyl)phenyl]isoquinolin-1(2h)-One
CID 53393807
2-[2-[[3-(Trifluoromethyl)phenyl]methylcarbamoyl]phenyl]benzoic acid
CID 1431346
4-[4-[[2-(Trifluoromethyl)phenyl]methylcarbamoyl]phenyl]benzoic acid
CID 127040870
3-[4-[[2-(Trifluoromethyl)phenyl]methylcarbamoyl]phenyl]benzoic acid
CID 127040871
N-[2-[[(1R,2S)-3-[(2,4-dimethylphenyl)methylamino]-1-hydroxy-1-phenylpropan-2-yl]amino]-2-oxoethyl]-3-(trifluoromethyl)benzamide
CID 10164641
4-{[(Naphthalene-2-carbonyl)amino]methyl}benzoic acid
CID 17171920
US8609678, 4-(bis(4-fluorophenyl)(hydroxy)methyl)-N-(7-(hydroxyamino)-7-oxoheptyl)benzamide [81]
CID 53340312
US8609678, 4-(bis(4-fluoro-2-methylphenyl)(hydroxy)methyl)-N-(7-(hydroxyamino)-7-oxoheptyl)benzamide [138]
CID 87356182
US8609678, 4-(bis(2-fluorophenyl)(hydroxy)methyl)-N-(7-(hydroxyamino)-7-oxoheptyl)benzamide [126]
CID 87376007
US8609678, 4-(bis(3-fluorophenyl)(hydroxy)methyl)-N-(7-(hydroxyamino)-7-oxoheptyl)benzamide [103]
CID 87376846

Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-N-(2-hydroxy-2-naphthalen-2-ylethyl)benzamide?
The IUPAC name of 2,6-difluoro-N-(2-hydroxy-2-naphthalen-2-ylethyl)benzamide (CID 3544778) is 2,6-difluoro-N-(2-hydroxy-2-naphthalen-2-ylethyl)benzamide.
What is the SMILES notation for 2,6-difluoro-N-(2-hydroxy-2-naphthalen-2-ylethyl)benzamide?
The canonical SMILES for 2,6-difluoro-N-(2-hydroxy-2-naphthalen-2-ylethyl)benzamide is O=C(NCC(O)c1ccc2ccccc2c1)c1c(F)cccc1F.
What is the InChIKey of 2,6-difluoro-N-(2-hydroxy-2-naphthalen-2-ylethyl)benzamide?
The InChIKey is AIYDWERSTIWQPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F2NO2/c20-15-6-3-7-16(21)18(15)19(24)22-11-17(23)14-9-8-12-4-1-2-5-13(12)10-14/h1-10,17,23H,11H2,(H,22,24).
What are the key properties of 2,6-difluoro-N-(2-hydroxy-2-naphthalen-2-ylethyl)benzamide?
2,6-difluoro-N-(2-hydroxy-2-naphthalen-2-ylethyl)benzamide has a molecular weight of 327.33 g/mol, XLogP of 3.58, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-N-(2-hydroxy-2-naphthalen-2-ylethyl)benzamide is sourced from PubChem (CID 3544778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).