4-[(4-hydroxyphenyl)methyl]-N-(3-methylphenyl)benzamide

C21H19NO2 — CID 167167317

IUPAC4-[(4-hydroxyphenyl)methyl]-N-(3-methylphenyl)benzamide
SMILESCc1cccc(NC(=O)c2ccc(Cc3ccc(O)cc3)cc2)c1
InChIInChI=1S/C21H19NO2/c1-15-3-2-4-19(13-15)22-21(24)18-9-5-16(6-10-18)14-17-7-11-20(23)12-8-17/h2-13,23H,14H2,1H3,(H,22,24)
InChIKeyMSCSOKDSORDHPT-UHFFFAOYSA-N
MW317.39 g/mol
LogP4.54
Rot. Bonds4

About 4-[(4-hydroxyphenyl)methyl]-N-(3-methylphenyl)benzamide

4-[(4-hydroxyphenyl)methyl]-N-(3-methylphenyl)benzamide (PubChem CID 167167317) has the molecular formula C21H19NO2 and a molecular weight of 317.39 g/mol. Its IUPAC name is 4-[(4-hydroxyphenyl)methyl]-N-(3-methylphenyl)benzamide.

Molecular Properties

Compound Name4-[(4-hydroxyphenyl)methyl]-N-(3-methylphenyl)benzamide
PubChem CID167167317
Molecular FormulaC21H19NO2
Molecular Weight317.39 g/mol
Exact Mass317.14
IUPAC Name4-[(4-hydroxyphenyl)methyl]-N-(3-methylphenyl)benzamide
SMILESCc1cccc(NC(=O)c2ccc(Cc3ccc(O)cc3)cc2)c1
InChIInChI=1S/C21H19NO2/c1-15-3-2-4-19(13-15)22-21(24)18-9-5-16(6-10-18)14-17-7-11-20(23)12-8-17/h2-13,23H,14H2,1H3,(H,22,24)
InChIKeyMSCSOKDSORDHPT-UHFFFAOYSA-N
XLogP4.54
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 54.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-methylphenyl)-4-(propan-2-yloxymethyl)benzamide
CID 8573875
4-N-(3-methylphenyl)-1-N-[(3-methylphenyl)methyl]benzene-1,4-dicarboxamide
CID 109046885
N-(3-methylphenyl)-4-[4-[(3-methylphenyl)carbamoyl]phenoxy]benzamide
CID 3539312
4-methyl-N-[4-[[4-[(4-methylbenzoyl)amino]phenyl]methyl]phenyl]benzamide
CID 2330632
4-[(2-methylanilino)methyl]-N-(3-methylphenyl)benzamide
CID 145489122
1-N-(4-fluorophenyl)-4-N-(3-methylphenyl)benzene-1,4-dicarboxamide
CID 109049357
1-N-methyl-3-N-(3-methylphenyl)benzene-1,3-dicarboxamide
CID 58018070
4-[(3-hydroxyazetidin-1-yl)methyl]-N-(3-methylphenyl)benzamide
CID 146477166
4-(ethylsulfonylamino)-N-(3-methylphenyl)benzamide
CID 2996698
5-hydroxy-N-(3-methylphenyl)pyridine-3-carboxamide
CID 63865627
1-N-cyclopropyl-4-N-(3-methylphenyl)benzene-1,4-dicarboxamide
CID 109043347
N-(3-methylphenyl)-4-phenoxybenzamide
CID 7946520

Frequently Asked Questions

What is the IUPAC name of 4-[(4-hydroxyphenyl)methyl]-N-(3-methylphenyl)benzamide?
The IUPAC name of 4-[(4-hydroxyphenyl)methyl]-N-(3-methylphenyl)benzamide (CID 167167317) is 4-[(4-hydroxyphenyl)methyl]-N-(3-methylphenyl)benzamide.
What is the SMILES notation for 4-[(4-hydroxyphenyl)methyl]-N-(3-methylphenyl)benzamide?
The canonical SMILES for 4-[(4-hydroxyphenyl)methyl]-N-(3-methylphenyl)benzamide is Cc1cccc(NC(=O)c2ccc(Cc3ccc(O)cc3)cc2)c1.
What is the InChIKey of 4-[(4-hydroxyphenyl)methyl]-N-(3-methylphenyl)benzamide?
The InChIKey is MSCSOKDSORDHPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO2/c1-15-3-2-4-19(13-15)22-21(24)18-9-5-16(6-10-18)14-17-7-11-20(23)12-8-17/h2-13,23H,14H2,1H3,(H,22,24).
What are the key properties of 4-[(4-hydroxyphenyl)methyl]-N-(3-methylphenyl)benzamide?
4-[(4-hydroxyphenyl)methyl]-N-(3-methylphenyl)benzamide has a molecular weight of 317.39 g/mol, XLogP of 4.54, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-hydroxyphenyl)methyl]-N-(3-methylphenyl)benzamide is sourced from PubChem (CID 167167317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).