N-(3-fluorophenyl)-N-[[4-(4-hydroxyphenyl)phenyl]methyl]benzamide

C26H20FNO2 — CID 156654005

IUPACN-(3-fluorophenyl)-N-[[4-(4-hydroxyphenyl)phenyl]methyl]benzamide
SMILESO=C(c1ccccc1)N(Cc1ccc(-c2ccc(O)cc2)cc1)c1cccc(F)c1
InChIInChI=1S/C26H20FNO2/c27-23-7-4-8-24(17-23)28(26(30)22-5-2-1-3-6-22)18-19-9-11-20(12-10-19)21-13-15-25(29)16-14-21/h1-17,29H,18H2
InChIKeyZBNZXJWWHLHNMB-UHFFFAOYSA-N
MW397.45 g/mol
LogP6.05
Rot. Bonds5

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

N-(3-fluorophenyl)-N-[[4-(4-hydroxyphenyl)phenyl]methyl]benzamide (PubChem CID 156654005) has the molecular formula C26H20FNO2 and a molecular weight of 397.45 g/mol. Its IUPAC name is N-(3-fluorophenyl)-N-[[4-(4-hydroxyphenyl)phenyl]methyl]benzamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-N-[[4-(4-hydroxyphenyl)phenyl]methyl]benzamide
PubChem CID156654005
Molecular FormulaC26H20FNO2
Molecular Weight397.45 g/mol
Exact Mass397.15
IUPAC NameN-(3-fluorophenyl)-N-[[4-(4-hydroxyphenyl)phenyl]methyl]benzamide
SMILESO=C(c1ccccc1)N(Cc1ccc(-c2ccc(O)cc2)cc1)c1cccc(F)c1
InChIInChI=1S/C26H20FNO2/c27-23-7-4-8-24(17-23)28(26(30)22-5-2-1-3-6-22)18-19-9-11-20(12-10-19)21-13-15-25(29)16-14-21/h1-17,29H,18H2
InChIKeyZBNZXJWWHLHNMB-UHFFFAOYSA-N
XLogP6.05
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500397.45
LogP ≤ 56.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[4-[(3-fluoro-N-pentanoylanilino)methyl]phenyl]benzoic acid
CID 71254804
N-[4-[2-[benzyl(methyl)amino]-2-oxoethyl]phenyl]-N-[(3-fluorophenyl)methyl]benzamide
CID 46052590
N-[4-[2-(benzylamino)-2-oxoethyl]phenyl]-N-[(3-fluorophenyl)methyl]benzamide
CID 46045890
N-benzyl-N-[3-[2-[2-(dimethylamino)ethylamino]-2-oxoethyl]phenyl]-3-fluorobenzamide
CID 42859313
N-[3-[2-(cyclopropylmethylamino)-2-oxoethyl]phenyl]-N-[(4-fluorophenyl)methyl]benzamide
CID 46056800
3-fluoro-N-[3-[2-(4-fluoroanilino)-2-oxoethyl]phenyl]-N-[(4-fluorophenyl)methyl]benzamide
CID 42859475
3-(3-fluoro-N-(3-fluorobenzoyl)anilino)propanoic acid
CID 82321619
N-[(4-fluorophenyl)methyl]-N-[3-[2-(3-methylanilino)-2-oxoethyl]phenyl]benzamide
CID 42859460
N-benzyl-3-fluoro-N-[3-[2-oxo-2-(pyridin-3-ylmethylamino)ethyl]phenyl]benzamide
CID 42859312
1-benzyl-3-[(3-fluorophenyl)methyl]-1-phenylurea
CID 108898536
N-benzyl-3,5-difluoro-N-(4-methylphenyl)benzamide
CID 22830347
benzyl-(3-hydroxyphenyl)carbamic acid
CID 71093078

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-N-[[4-(4-hydroxyphenyl)phenyl]methyl]benzamide?
The IUPAC name of N-(3-fluorophenyl)-N-[[4-(4-hydroxyphenyl)phenyl]methyl]benzamide (CID 156654005) is N-(3-fluorophenyl)-N-[[4-(4-hydroxyphenyl)phenyl]methyl]benzamide.
What is the SMILES notation for N-(3-fluorophenyl)-N-[[4-(4-hydroxyphenyl)phenyl]methyl]benzamide?
The canonical SMILES for N-(3-fluorophenyl)-N-[[4-(4-hydroxyphenyl)phenyl]methyl]benzamide is O=C(c1ccccc1)N(Cc1ccc(-c2ccc(O)cc2)cc1)c1cccc(F)c1.
What is the InChIKey of N-(3-fluorophenyl)-N-[[4-(4-hydroxyphenyl)phenyl]methyl]benzamide?
The InChIKey is ZBNZXJWWHLHNMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20FNO2/c27-23-7-4-8-24(17-23)28(26(30)22-5-2-1-3-6-22)18-19-9-11-20(12-10-19)21-13-15-25(29)16-14-21/h1-17,29H,18H2.
What are the key properties of N-(3-fluorophenyl)-N-[[4-(4-hydroxyphenyl)phenyl]methyl]benzamide?
N-(3-fluorophenyl)-N-[[4-(4-hydroxyphenyl)phenyl]methyl]benzamide has a molecular weight of 397.45 g/mol, XLogP of 6.05, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-N-[[4-(4-hydroxyphenyl)phenyl]methyl]benzamide is sourced from PubChem (CID 156654005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).