N-(4-fluoro-3-methylphenyl)-3,5-dihydroxybenzamide

C14H12FNO3 — CID 104938981

IUPACN-(4-fluoro-3-methylphenyl)-3,5-dihydroxybenzamide
SMILESCc1cc(NC(=O)c2cc(O)cc(O)c2)ccc1F
InChIInChI=1S/C14H12FNO3/c1-8-4-10(2-3-13(8)15)16-14(19)9-5-11(17)7-12(18)6-9/h2-7,17-18H,1H3,(H,16,19)
InChIKeyNHXZJGNRBGLRHZ-UHFFFAOYSA-N
MW261.25 g/mol
LogP2.80
Rot. Bonds2

About N-(4-fluoro-3-methylphenyl)-3,5-dihydroxybenzamide

N-(4-fluoro-3-methylphenyl)-3,5-dihydroxybenzamide (PubChem CID 104938981) has the molecular formula C14H12FNO3 and a molecular weight of 261.25 g/mol. Its IUPAC name is N-(4-fluoro-3-methylphenyl)-3,5-dihydroxybenzamide.

Molecular Properties

Compound NameN-(4-fluoro-3-methylphenyl)-3,5-dihydroxybenzamide
PubChem CID104938981
Molecular FormulaC14H12FNO3
Molecular Weight261.25 g/mol
Exact Mass261.08
IUPAC NameN-(4-fluoro-3-methylphenyl)-3,5-dihydroxybenzamide
SMILESCc1cc(NC(=O)c2cc(O)cc(O)c2)ccc1F
InChIInChI=1S/C14H12FNO3/c1-8-4-10(2-3-13(8)15)16-14(19)9-5-11(17)7-12(18)6-9/h2-7,17-18H,1H3,(H,16,19)
InChIKeyNHXZJGNRBGLRHZ-UHFFFAOYSA-N
XLogP2.80
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.25
LogP ≤ 52.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide;hydrochloride
CID 110776367
N-(3-bromo-4-methylphenyl)-3,5-dihydroxybenzamide
CID 107703359
N-(4-fluoro-3-methylphenyl)-3-hydroxy-4-iodobenzamide
CID 104628285
N-(4-fluorophenyl)-3,5-dihydroxybenzamide
CID 103891338
3-[(4-fluoro-3-methylphenyl)carbamoyl]benzoic acid
CID 62812413
N-(3-fluoro-4-methoxyphenyl)-3,5-dihydroxybenzamide
CID 103892052
N-(2,5-difluoro-4-methylphenyl)-3,5-dihydroxybenzamide
CID 107704386
3-amino-4-bromo-N-(4-fluoro-3-methylphenyl)benzamide
CID 55118828
2-amino-N-(4-fluoro-3-methylphenyl)-5-hydroxybenzamide
CID 107075174
5-bromo-N-(4-fluoro-3-methylphenyl)thiophene-3-carboxamide
CID 62812532
1-N,3-N-bis(3-amino-4-methylphenyl)-5-hydroxybenzene-1,3-dicarboxamide
CID 139753115
2-bromo-N-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide
CID 103755165

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-3-methylphenyl)-3,5-dihydroxybenzamide?
The IUPAC name of N-(4-fluoro-3-methylphenyl)-3,5-dihydroxybenzamide (CID 104938981) is N-(4-fluoro-3-methylphenyl)-3,5-dihydroxybenzamide.
What is the SMILES notation for N-(4-fluoro-3-methylphenyl)-3,5-dihydroxybenzamide?
The canonical SMILES for N-(4-fluoro-3-methylphenyl)-3,5-dihydroxybenzamide is Cc1cc(NC(=O)c2cc(O)cc(O)c2)ccc1F.
What is the InChIKey of N-(4-fluoro-3-methylphenyl)-3,5-dihydroxybenzamide?
The InChIKey is NHXZJGNRBGLRHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FNO3/c1-8-4-10(2-3-13(8)15)16-14(19)9-5-11(17)7-12(18)6-9/h2-7,17-18H,1H3,(H,16,19).
What are the key properties of N-(4-fluoro-3-methylphenyl)-3,5-dihydroxybenzamide?
N-(4-fluoro-3-methylphenyl)-3,5-dihydroxybenzamide has a molecular weight of 261.25 g/mol, XLogP of 2.80, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-3-methylphenyl)-3,5-dihydroxybenzamide is sourced from PubChem (CID 104938981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).