2-chloro-N-[4-(2,6-diphenyl-4-pyridinyl)phenyl]acetamide

C25H19ClN2O — CID 67597420

IUPAC2-chloro-N-[4-(2,6-diphenyl-4-pyridinyl)phenyl]acetamide
SMILESO=C(CCl)Nc1ccc(-c2cc(-c3ccccc3)nc(-c3ccccc3)c2)cc1
InChIInChI=1S/C25H19ClN2O/c26-17-25(29)27-22-13-11-18(12-14-22)21-15-23(19-7-3-1-4-8-19)28-24(16-21)20-9-5-2-6-10-20/h1-16H,17H2,(H,27,29)
InChIKeyVYTDZQJYUXXDKQ-UHFFFAOYSA-N
MW398.89 g/mol
LogP6.26
Rot. Bonds5

About 2-chloro-N-[4-(2,6-diphenyl-4-pyridinyl)phenyl]acetamide

2-chloro-N-[4-(2,6-diphenyl-4-pyridinyl)phenyl]acetamide (PubChem CID 67597420) has the molecular formula C25H19ClN2O and a molecular weight of 398.89 g/mol. Its IUPAC name is 2-chloro-N-[4-(2,6-diphenyl-4-pyridinyl)phenyl]acetamide.

Molecular Properties

Compound Name2-chloro-N-[4-(2,6-diphenyl-4-pyridinyl)phenyl]acetamide
PubChem CID67597420
Molecular FormulaC25H19ClN2O
Molecular Weight398.89 g/mol
Exact Mass398.12
IUPAC Name2-chloro-N-[4-(2,6-diphenyl-4-pyridinyl)phenyl]acetamide
SMILESO=C(CCl)Nc1ccc(-c2cc(-c3ccccc3)nc(-c3ccccc3)c2)cc1
InChIInChI=1S/C25H19ClN2O/c26-17-25(29)27-22-13-11-18(12-14-22)21-15-23(19-7-3-1-4-8-19)28-24(16-21)20-9-5-2-6-10-20/h1-16H,17H2,(H,27,29)
InChIKeyVYTDZQJYUXXDKQ-UHFFFAOYSA-N
XLogP6.26
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500398.89
LogP ≤ 56.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

4-[3,5-bis(4-phenylphenyl)phenyl]-2,6-diphenylpyridine
CID 58943272
2,4-diphenyl-6-[4-[3-phenyl-5-(4-phenylphenyl)phenyl]phenyl]pyridine
CID 58943632
2-chloro-N-(4-pyrimidin-5-ylphenyl)acetamide
CID 166404220
2-chloro-N-[4-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]phenyl]acetamide
CID 108748184
2-phenyl-4,6-bis[3-phenyl-5-(4-phenylphenyl)phenyl]pyridine
CID 121311684
2-chloro-N-(2-phenylpyrimidin-5-yl)acetamide
CID 43699755
4-[3-(2,6-diphenyl-4-pyridinyl)-5-phenylphenyl]-2,6-diphenylpyridine
CID 59428704
2-chloro-N-[3-(3-phenylbenzo[f]quinolin-1-yl)phenyl]acetamide
CID 4138737
2-amino-N-(4-phenylphenyl)acetamide
CID 43218250
2-chloro-N-(4-phenylsulfanylphenyl)acetamide
CID 12734393
4-(2,6-diphenyl-4-pyridinyl)phenol
CID 4640455
2,4-bis(4-chlorophenyl)-6-phenylpyridine
CID 3640020

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[4-(2,6-diphenyl-4-pyridinyl)phenyl]acetamide?
The IUPAC name of 2-chloro-N-[4-(2,6-diphenyl-4-pyridinyl)phenyl]acetamide (CID 67597420) is 2-chloro-N-[4-(2,6-diphenyl-4-pyridinyl)phenyl]acetamide.
What is the SMILES notation for 2-chloro-N-[4-(2,6-diphenyl-4-pyridinyl)phenyl]acetamide?
The canonical SMILES for 2-chloro-N-[4-(2,6-diphenyl-4-pyridinyl)phenyl]acetamide is O=C(CCl)Nc1ccc(-c2cc(-c3ccccc3)nc(-c3ccccc3)c2)cc1.
What is the InChIKey of 2-chloro-N-[4-(2,6-diphenyl-4-pyridinyl)phenyl]acetamide?
The InChIKey is VYTDZQJYUXXDKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19ClN2O/c26-17-25(29)27-22-13-11-18(12-14-22)21-15-23(19-7-3-1-4-8-19)28-24(16-21)20-9-5-2-6-10-20/h1-16H,17H2,(H,27,29).
What are the key properties of 2-chloro-N-[4-(2,6-diphenyl-4-pyridinyl)phenyl]acetamide?
2-chloro-N-[4-(2,6-diphenyl-4-pyridinyl)phenyl]acetamide has a molecular weight of 398.89 g/mol, XLogP of 6.26, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[4-(2,6-diphenyl-4-pyridinyl)phenyl]acetamide is sourced from PubChem (CID 67597420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).