2-[2-(3-chloro-2-phenylmethoxyphenyl)phenyl]benzamide

C26H20ClNO2 — CID 69309565

IUPAC2-[2-(3-chloro-2-phenylmethoxyphenyl)phenyl]benzamide
SMILESNC(=O)c1ccccc1-c1ccccc1-c1cccc(Cl)c1OCc1ccccc1
InChIInChI=1S/C26H20ClNO2/c27-24-16-8-15-22(25(24)30-17-18-9-2-1-3-10-18)20-12-5-4-11-19(20)21-13-6-7-14-23(21)26(28)29/h1-16H,17H2,(H2,28,29)
InChIKeyUFLZGTQALOXSPR-UHFFFAOYSA-N
MW413.90 g/mol
LogP6.35
Rot. Bonds6

About 2-[2-(3-chloro-2-phenylmethoxyphenyl)phenyl]benzamide

2-[2-(3-chloro-2-phenylmethoxyphenyl)phenyl]benzamide (PubChem CID 69309565) has the molecular formula C26H20ClNO2 and a molecular weight of 413.90 g/mol. Its IUPAC name is 2-[2-(3-chloro-2-phenylmethoxyphenyl)phenyl]benzamide.

Molecular Properties

Compound Name2-[2-(3-chloro-2-phenylmethoxyphenyl)phenyl]benzamide
PubChem CID69309565
Molecular FormulaC26H20ClNO2
Molecular Weight413.90 g/mol
Exact Mass413.12
IUPAC Name2-[2-(3-chloro-2-phenylmethoxyphenyl)phenyl]benzamide
SMILESNC(=O)c1ccccc1-c1ccccc1-c1cccc(Cl)c1OCc1ccccc1
InChIInChI=1S/C26H20ClNO2/c27-24-16-8-15-22(25(24)30-17-18-9-2-1-3-10-18)20-12-5-4-11-19(20)21-13-6-7-14-23(21)26(28)29/h1-16H,17H2,(H2,28,29)
InChIKeyUFLZGTQALOXSPR-UHFFFAOYSA-N
XLogP6.35
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500413.90
LogP ≤ 56.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,6-dichlorophenyl)benzamide
CID 67032434
3-nitro-2-phenylmethoxybenzamide
CID 18551383
3-chloro-2-[(4-methylphenyl)methoxy]benzoic acid
CID 112612027
3-chloro-2-(pyridin-4-ylmethoxy)benzoic acid
CID 112612042
2-benzyl-3-chlorobenzamide
CID 23225157
2-[4-[(2,6-dichlorophenoxy)methyl]phenyl]acetohydrazide
CID 105351478
2-[(3-phenylmethoxyphenyl)methoxy]benzamide
CID 60603891
1-chloro-3-methyl-2-phenylmethoxybenzene
CID 71366901
4-chloro-2-fluoro-3-phenylmethoxybenzoic acid
CID 164891597
3-hydroxy-2-phenylmethoxybenzoic acid
CID 67658329
3-[(2,6-dichlorophenoxy)methyl]benzoic acid
CID 19619632
2-[(4-phenylphenyl)methoxy]benzamide
CID 8011325

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-chloro-2-phenylmethoxyphenyl)phenyl]benzamide?
The IUPAC name of 2-[2-(3-chloro-2-phenylmethoxyphenyl)phenyl]benzamide (CID 69309565) is 2-[2-(3-chloro-2-phenylmethoxyphenyl)phenyl]benzamide.
What is the SMILES notation for 2-[2-(3-chloro-2-phenylmethoxyphenyl)phenyl]benzamide?
The canonical SMILES for 2-[2-(3-chloro-2-phenylmethoxyphenyl)phenyl]benzamide is NC(=O)c1ccccc1-c1ccccc1-c1cccc(Cl)c1OCc1ccccc1.
What is the InChIKey of 2-[2-(3-chloro-2-phenylmethoxyphenyl)phenyl]benzamide?
The InChIKey is UFLZGTQALOXSPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20ClNO2/c27-24-16-8-15-22(25(24)30-17-18-9-2-1-3-10-18)20-12-5-4-11-19(20)21-13-6-7-14-23(21)26(28)29/h1-16H,17H2,(H2,28,29).
What are the key properties of 2-[2-(3-chloro-2-phenylmethoxyphenyl)phenyl]benzamide?
2-[2-(3-chloro-2-phenylmethoxyphenyl)phenyl]benzamide has a molecular weight of 413.90 g/mol, XLogP of 6.35, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-chloro-2-phenylmethoxyphenyl)phenyl]benzamide is sourced from PubChem (CID 69309565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).