4-hydroxy-N-(3-hydroxyphenyl)-N,3-dimethylbenzamide

C15H15NO3 — CID 107735629

IUPAC4-hydroxy-N-(3-hydroxyphenyl)-N,3-dimethylbenzamide
SMILESCc1cc(C(=O)N(C)c2cccc(O)c2)ccc1O
InChIInChI=1S/C15H15NO3/c1-10-8-11(6-7-14(10)18)15(19)16(2)12-4-3-5-13(17)9-12/h3-9,17-18H,1-2H3
InChIKeyHJXBMWBQEHLWBU-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.68
Rot. Bonds2

About 4-hydroxy-N-(3-hydroxyphenyl)-N,3-dimethylbenzamide

4-hydroxy-N-(3-hydroxyphenyl)-N,3-dimethylbenzamide (PubChem CID 107735629) has the molecular formula C15H15NO3 and a molecular weight of 257.29 g/mol. Its IUPAC name is 4-hydroxy-N-(3-hydroxyphenyl)-N,3-dimethylbenzamide.

Molecular Properties

Compound Name4-hydroxy-N-(3-hydroxyphenyl)-N,3-dimethylbenzamide
PubChem CID107735629
Molecular FormulaC15H15NO3
Molecular Weight257.29 g/mol
Exact Mass257.11
IUPAC Name4-hydroxy-N-(3-hydroxyphenyl)-N,3-dimethylbenzamide
SMILESCc1cc(C(=O)N(C)c2cccc(O)c2)ccc1O
InChIInChI=1S/C15H15NO3/c1-10-8-11(6-7-14(10)18)15(19)16(2)12-4-3-5-13(17)9-12/h3-9,17-18H,1-2H3
InChIKeyHJXBMWBQEHLWBU-UHFFFAOYSA-N
XLogP2.68
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dihydroxy-N-(3-hydroxyphenyl)-N-methylbenzamide
CID 107735623
3,5-dihydroxy-N-(3-hydroxyphenyl)-N-methylbenzamide
CID 107735650
3,4-difluoro-N-(3-hydroxyphenyl)-N-methylbenzamide
CID 107735801
N-(3-hydroxyphenyl)-N,2-dimethylpyridine-4-carboxamide
CID 107735739
N-(3-hydroxyphenyl)-N-methyl-4-methylsulfanylbenzamide
CID 107736061
N-(3-hydroxyphenyl)-N-methylpyridine-4-carboxamide
CID 107735844
4-hydroxy-N,N,3-trimethylbenzamide
CID 59263635
3-hydroxy-N-(4-hydroxyphenyl)-N-methylbenzamide
CID 28739062
N-(3-hydroxyphenyl)-N-methyl-1H-indazole-6-carboxamide
CID 107735897
6-fluoro-N-(3-hydroxyphenyl)-N-methylpyridine-3-carboxamide
CID 114009640
3,4-dihydroxy-N-methyl-N-phenylbenzamide
CID 113199261
3-(difluoromethoxy)-N-(3-hydroxyphenyl)-N-methylbenzamide
CID 107735708

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(3-hydroxyphenyl)-N,3-dimethylbenzamide?
The IUPAC name of 4-hydroxy-N-(3-hydroxyphenyl)-N,3-dimethylbenzamide (CID 107735629) is 4-hydroxy-N-(3-hydroxyphenyl)-N,3-dimethylbenzamide.
What is the SMILES notation for 4-hydroxy-N-(3-hydroxyphenyl)-N,3-dimethylbenzamide?
The canonical SMILES for 4-hydroxy-N-(3-hydroxyphenyl)-N,3-dimethylbenzamide is Cc1cc(C(=O)N(C)c2cccc(O)c2)ccc1O.
What is the InChIKey of 4-hydroxy-N-(3-hydroxyphenyl)-N,3-dimethylbenzamide?
The InChIKey is HJXBMWBQEHLWBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO3/c1-10-8-11(6-7-14(10)18)15(19)16(2)12-4-3-5-13(17)9-12/h3-9,17-18H,1-2H3.
What are the key properties of 4-hydroxy-N-(3-hydroxyphenyl)-N,3-dimethylbenzamide?
4-hydroxy-N-(3-hydroxyphenyl)-N,3-dimethylbenzamide has a molecular weight of 257.29 g/mol, XLogP of 2.68, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(3-hydroxyphenyl)-N,3-dimethylbenzamide is sourced from PubChem (CID 107735629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).