2-fluoro-6-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide

C12H14FNO3 — CID 107015730

IUPAC2-fluoro-6-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide
SMILESO=C(NCC1CC(O)C1)c1c(O)cccc1F
InChIInChI=1S/C12H14FNO3/c13-9-2-1-3-10(16)11(9)12(17)14-6-7-4-8(15)5-7/h1-3,7-8,15-16H,4-6H2,(H,14,17)
InChIKeyIYPKKYZOVOAWSA-UHFFFAOYSA-N
MW239.25 g/mol
LogP1.03
Rot. Bonds3

About 2-fluoro-6-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide

2-fluoro-6-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide (PubChem CID 107015730) has the molecular formula C12H14FNO3 and a molecular weight of 239.25 g/mol. Its IUPAC name is 2-fluoro-6-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide.

Molecular Properties

Compound Name2-fluoro-6-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide
PubChem CID107015730
Molecular FormulaC12H14FNO3
Molecular Weight239.25 g/mol
Exact Mass239.10
IUPAC Name2-fluoro-6-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide
SMILESO=C(NCC1CC(O)C1)c1c(O)cccc1F
InChIInChI=1S/C12H14FNO3/c13-9-2-1-3-10(16)11(9)12(17)14-6-7-4-8(15)5-7/h1-3,7-8,15-16H,4-6H2,(H,14,17)
InChIKeyIYPKKYZOVOAWSA-UHFFFAOYSA-N
XLogP1.03
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.25
LogP ≤ 51.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-fluoro-6-hydroxy-N-[(3-hydroxycyclobutyl)methyl]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

3-fluoro-N-[(3-hydroxycyclobutyl)methyl]benzamide
CID 66005334
N-[(1,4-dimethylpiperazin-2-yl)methyl]-2-fluoro-6-hydroxybenzamide
CID 104917543
2-fluoro-6-hydroxy-N-[(2-methylcyclohexyl)methyl]benzamide
CID 107015192
N-[(3-hydroxycyclobutyl)methyl]-2,6-dimethoxybenzamide
CID 66004920
N-[[(2R,4S)-1-benzyl-4-hydroxypyrrolidin-2-yl]methyl]-2-fluoro-6-hydroxybenzamide
CID 99822735
5-chloro-2-fluoro-N-[(3-hydroxycyclobutyl)methyl]benzamide
CID 66004553
5-chloro-2-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide
CID 66005764
N-[(4-aminocyclohexyl)methyl]-2,6-difluorobenzamide
CID 106124024
2,5-dihydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide
CID 107724816
4-fluoro-N-[(3-hydroxycyclobutyl)methyl]benzamide
CID 66006045
N-(2-chloroethyl)-2-fluoro-6-hydroxybenzamide
CID 107016788
4-fluoro-N-[(3-hydroxycyclobutyl)methyl]-3-methyl-1-benzothiophene-2-carboxamide
CID 66004913

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-6-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide?
The IUPAC name of 2-fluoro-6-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide (CID 107015730) is 2-fluoro-6-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide.
What is the SMILES notation for 2-fluoro-6-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide?
The canonical SMILES for 2-fluoro-6-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide is O=C(NCC1CC(O)C1)c1c(O)cccc1F.
What is the InChIKey of 2-fluoro-6-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide?
The InChIKey is IYPKKYZOVOAWSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FNO3/c13-9-2-1-3-10(16)11(9)12(17)14-6-7-4-8(15)5-7/h1-3,7-8,15-16H,4-6H2,(H,14,17).
What are the key properties of 2-fluoro-6-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide?
2-fluoro-6-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide has a molecular weight of 239.25 g/mol, XLogP of 1.03, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide is sourced from PubChem (CID 107015730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).