N-[2-(2-fluorophenyl)cyclopropyl]-3-hydroxy-4-methoxybenzamide

C17H16FNO3 — CID 75424329

IUPACN-[2-(2-fluorophenyl)cyclopropyl]-3-hydroxy-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2CC2c2ccccc2F)cc1O
InChIInChI=1S/C17H16FNO3/c1-22-16-7-6-10(8-15(16)20)17(21)19-14-9-12(14)11-4-2-3-5-13(11)18/h2-8,12,14,20H,9H2,1H3,(H,19,21)
InChIKeyYNHBHHZUFIFFNQ-UHFFFAOYSA-N
MW301.32 g/mol
LogP2.83
Rot. Bonds4

About N-[2-(2-fluorophenyl)cyclopropyl]-3-hydroxy-4-methoxybenzamide

N-[2-(2-fluorophenyl)cyclopropyl]-3-hydroxy-4-methoxybenzamide (PubChem CID 75424329) has the molecular formula C17H16FNO3 and a molecular weight of 301.32 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)cyclopropyl]-3-hydroxy-4-methoxybenzamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)cyclopropyl]-3-hydroxy-4-methoxybenzamide
PubChem CID75424329
Molecular FormulaC17H16FNO3
Molecular Weight301.32 g/mol
Exact Mass301.11
IUPAC NameN-[2-(2-fluorophenyl)cyclopropyl]-3-hydroxy-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2CC2c2ccccc2F)cc1O
InChIInChI=1S/C17H16FNO3/c1-22-16-7-6-10(8-15(16)20)17(21)19-14-9-12(14)11-4-2-3-5-13(11)18/h2-8,12,14,20H,9H2,1H3,(H,19,21)
InChIKeyYNHBHHZUFIFFNQ-UHFFFAOYSA-N
XLogP2.83
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.32
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[2-(2-fluorophenyl)cyclopropyl]-3-hydroxy-4-methoxybenzamide 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-cyclohexyl-3-hydroxy-4-methoxybenzamide
CID 79600190
3-hydroxy-4-methoxy-N-(3-methoxycyclopentyl)benzamide
CID 103099443
3-fluoro-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)-4-methoxybenzamide
CID 110903576
N-[2-(aminomethyl)cyclopentyl]-3-hydroxy-4-methoxybenzamide
CID 79725712
3-hydroxy-4-methoxy-N-piperidin-4-ylbenzamide
CID 79725951
4-fluoro-3-methyl-N-(2-phenylcyclopropyl)benzamide
CID 63213326
3-hydroxy-4-methoxy-N-(2-methoxyphenyl)benzamide
CID 79600198
3-hydroxy-4-methoxy-N-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]benzamide
CID 133265575
3-fluoro-4-methoxy-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 32745617
N-[(1R,2S)-2-(3-chlorophenyl)cyclopropyl]-4-hydroxy-3,5-dimethoxybenzamide
CID 122149915
3-hydroxy-4-methoxybenzoic acid
CID 12575
N-(3-amino-2,2,4,4-tetramethylcyclobutyl)-3-hydroxy-4-methoxybenzamide
CID 79735299

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)cyclopropyl]-3-hydroxy-4-methoxybenzamide?
The IUPAC name of N-[2-(2-fluorophenyl)cyclopropyl]-3-hydroxy-4-methoxybenzamide (CID 75424329) is N-[2-(2-fluorophenyl)cyclopropyl]-3-hydroxy-4-methoxybenzamide.
What is the SMILES notation for N-[2-(2-fluorophenyl)cyclopropyl]-3-hydroxy-4-methoxybenzamide?
The canonical SMILES for N-[2-(2-fluorophenyl)cyclopropyl]-3-hydroxy-4-methoxybenzamide is COc1ccc(C(=O)NC2CC2c2ccccc2F)cc1O.
What is the InChIKey of N-[2-(2-fluorophenyl)cyclopropyl]-3-hydroxy-4-methoxybenzamide?
The InChIKey is YNHBHHZUFIFFNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16FNO3/c1-22-16-7-6-10(8-15(16)20)17(21)19-14-9-12(14)11-4-2-3-5-13(11)18/h2-8,12,14,20H,9H2,1H3,(H,19,21).
What are the key properties of N-[2-(2-fluorophenyl)cyclopropyl]-3-hydroxy-4-methoxybenzamide?
N-[2-(2-fluorophenyl)cyclopropyl]-3-hydroxy-4-methoxybenzamide has a molecular weight of 301.32 g/mol, XLogP of 2.83, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)cyclopropyl]-3-hydroxy-4-methoxybenzamide is sourced from PubChem (CID 75424329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).