5-fluoro-2-hydroxy-N-[(1-methylcyclopropyl)methyl]benzamide

C12H14FNO2 — CID 103739179

IUPAC5-fluoro-2-hydroxy-N-[(1-methylcyclopropyl)methyl]benzamide
SMILESCC1(CNC(=O)c2cc(F)ccc2O)CC1
InChIInChI=1S/C12H14FNO2/c1-12(4-5-12)7-14-11(16)9-6-8(13)2-3-10(9)15/h2-3,6,15H,4-5,7H2,1H3,(H,14,16)
InChIKeyVVPHYPLGEFFXNP-UHFFFAOYSA-N
MW223.25 g/mol
LogP2.06
Rot. Bonds3

About 5-fluoro-2-hydroxy-N-[(1-methylcyclopropyl)methyl]benzamide

5-fluoro-2-hydroxy-N-[(1-methylcyclopropyl)methyl]benzamide (PubChem CID 103739179) has the molecular formula C12H14FNO2 and a molecular weight of 223.25 g/mol. Its IUPAC name is 5-fluoro-2-hydroxy-N-[(1-methylcyclopropyl)methyl]benzamide.

Molecular Properties

Compound Name5-fluoro-2-hydroxy-N-[(1-methylcyclopropyl)methyl]benzamide
PubChem CID103739179
Molecular FormulaC12H14FNO2
Molecular Weight223.25 g/mol
Exact Mass223.10
IUPAC Name5-fluoro-2-hydroxy-N-[(1-methylcyclopropyl)methyl]benzamide
SMILESCC1(CNC(=O)c2cc(F)ccc2O)CC1
InChIInChI=1S/C12H14FNO2/c1-12(4-5-12)7-14-11(16)9-6-8(13)2-3-10(9)15/h2-3,6,15H,4-5,7H2,1H3,(H,14,16)
InChIKeyVVPHYPLGEFFXNP-UHFFFAOYSA-N
XLogP2.06
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.25
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-fluoro-2-hydroxy-N-[(3-methylpyrrolidin-3-yl)methyl]benzamide
CID 114217968
N-ethyl-5-fluoro-2-hydroxybenzamide
CID 79531934
4-fluoro-2-methyl-N-[(1-methylcyclobutyl)methyl]benzamide
CID 103820345
5-fluoro-2-hydroxy-N-(1-methylcyclopropyl)benzamide
CID 115883770
2-amino-N-[(1,4-dimethylpiperidin-4-yl)methyl]-5-fluorobenzamide
CID 107162857
5-fluoro-2-hydroxy-N-(2-hydroxyethyl)benzamide
CID 67742481
3-hydroxy-2-methyl-N-[(1-methylcyclopropyl)methyl]benzamide
CID 103873632
4-bromo-2-fluoro-N-[(1-methylcyclopropyl)methyl]benzamide
CID 103722151
2-fluoro-3-methyl-N-[(1-methylcyclopropyl)methyl]benzamide
CID 103765513
2-fluoro-N-[(1-methylcyclopropyl)methyl]-4-sulfamoylbenzamide
CID 113346358
N-(3-amino-2,2-dimethylpropyl)-5-fluoro-2-hydroxybenzamide
CID 115365585
2-hydroxy-N-[(4-methyloxan-4-yl)methyl]benzamide
CID 103742541

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-hydroxy-N-[(1-methylcyclopropyl)methyl]benzamide?
The IUPAC name of 5-fluoro-2-hydroxy-N-[(1-methylcyclopropyl)methyl]benzamide (CID 103739179) is 5-fluoro-2-hydroxy-N-[(1-methylcyclopropyl)methyl]benzamide.
What is the SMILES notation for 5-fluoro-2-hydroxy-N-[(1-methylcyclopropyl)methyl]benzamide?
The canonical SMILES for 5-fluoro-2-hydroxy-N-[(1-methylcyclopropyl)methyl]benzamide is CC1(CNC(=O)c2cc(F)ccc2O)CC1.
What is the InChIKey of 5-fluoro-2-hydroxy-N-[(1-methylcyclopropyl)methyl]benzamide?
The InChIKey is VVPHYPLGEFFXNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FNO2/c1-12(4-5-12)7-14-11(16)9-6-8(13)2-3-10(9)15/h2-3,6,15H,4-5,7H2,1H3,(H,14,16).
What are the key properties of 5-fluoro-2-hydroxy-N-[(1-methylcyclopropyl)methyl]benzamide?
5-fluoro-2-hydroxy-N-[(1-methylcyclopropyl)methyl]benzamide has a molecular weight of 223.25 g/mol, XLogP of 2.06, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-hydroxy-N-[(1-methylcyclopropyl)methyl]benzamide is sourced from PubChem (CID 103739179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).