N-(5-amino-2-fluorophenyl)-4-hydroxy-2-methylbenzamide

C14H13FN2O2 — CID 107670559

IUPACN-(5-amino-2-fluorophenyl)-4-hydroxy-2-methylbenzamide
SMILESCc1cc(O)ccc1C(=O)Nc1cc(N)ccc1F
InChIInChI=1S/C14H13FN2O2/c1-8-6-10(18)3-4-11(8)14(19)17-13-7-9(16)2-5-12(13)15/h2-7,18H,16H2,1H3,(H,17,19)
InChIKeyNFANQCDMQNBEFK-UHFFFAOYSA-N
MW260.27 g/mol
LogP2.67
Rot. Bonds2

About N-(5-amino-2-fluorophenyl)-4-hydroxy-2-methylbenzamide

N-(5-amino-2-fluorophenyl)-4-hydroxy-2-methylbenzamide (PubChem CID 107670559) has the molecular formula C14H13FN2O2 and a molecular weight of 260.27 g/mol. Its IUPAC name is N-(5-amino-2-fluorophenyl)-4-hydroxy-2-methylbenzamide.

Molecular Properties

Compound NameN-(5-amino-2-fluorophenyl)-4-hydroxy-2-methylbenzamide
PubChem CID107670559
Molecular FormulaC14H13FN2O2
Molecular Weight260.27 g/mol
Exact Mass260.10
IUPAC NameN-(5-amino-2-fluorophenyl)-4-hydroxy-2-methylbenzamide
SMILESCc1cc(O)ccc1C(=O)Nc1cc(N)ccc1F
InChIInChI=1S/C14H13FN2O2/c1-8-6-10(18)3-4-11(8)14(19)17-13-7-9(16)2-5-12(13)15/h2-7,18H,16H2,1H3,(H,17,19)
InChIKeyNFANQCDMQNBEFK-UHFFFAOYSA-N
XLogP2.67
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.27
LogP ≤ 52.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

4-hydroxy-2-methyl-N-(2,4,5-trifluorophenyl)benzamide
CID 103863779
N-(2-fluoro-5-methoxyphenyl)-4-hydroxy-2-methylbenzamide
CID 103865750
4-amino-N-(5-bromo-2,4-difluorophenyl)-2-methylbenzamide
CID 102852303
4-amino-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid
CID 107674554
4-amino-2-chloro-N-(4-hydroxy-2-methylphenyl)benzamide
CID 110464996
N-(5-amino-2-fluorophenyl)-3,5-dimethylbenzamide
CID 16771732
4-amino-2-fluoro-N-(2-hydroxy-3,5-dimethylphenyl)benzamide
CID 107794653
4-fluoro-N-(2-fluoro-5-methylphenyl)-2-methylbenzamide
CID 112702327
N-(2,5-dichloro-4-methylphenyl)-4-hydroxy-2-methylbenzamide
CID 107671657
N-(2-bromo-4-fluorophenyl)-4-hydroxy-2-methylbenzamide
CID 107671523
N-(5-amino-2-fluorophenyl)-2-methylquinoline-4-carboxamide
CID 24698449
N-(5-amino-2-methylphenyl)-4-hydroxybenzamide
CID 22291140

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-fluorophenyl)-4-hydroxy-2-methylbenzamide?
The IUPAC name of N-(5-amino-2-fluorophenyl)-4-hydroxy-2-methylbenzamide (CID 107670559) is N-(5-amino-2-fluorophenyl)-4-hydroxy-2-methylbenzamide.
What is the SMILES notation for N-(5-amino-2-fluorophenyl)-4-hydroxy-2-methylbenzamide?
The canonical SMILES for N-(5-amino-2-fluorophenyl)-4-hydroxy-2-methylbenzamide is Cc1cc(O)ccc1C(=O)Nc1cc(N)ccc1F.
What is the InChIKey of N-(5-amino-2-fluorophenyl)-4-hydroxy-2-methylbenzamide?
The InChIKey is NFANQCDMQNBEFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O2/c1-8-6-10(18)3-4-11(8)14(19)17-13-7-9(16)2-5-12(13)15/h2-7,18H,16H2,1H3,(H,17,19).
What are the key properties of N-(5-amino-2-fluorophenyl)-4-hydroxy-2-methylbenzamide?
N-(5-amino-2-fluorophenyl)-4-hydroxy-2-methylbenzamide has a molecular weight of 260.27 g/mol, XLogP of 2.67, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-fluorophenyl)-4-hydroxy-2-methylbenzamide is sourced from PubChem (CID 107670559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).