2-(3,5-dichlorophenyl)-2-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)acetamide

C16H16Cl2N2O2 — CID 75436856

IUPAC2-(3,5-dichlorophenyl)-2-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)acetamide
SMILESCN(CCc1ccccn1)C(=O)C(O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C16H16Cl2N2O2/c1-20(7-5-14-4-2-3-6-19-14)16(22)15(21)11-8-12(17)10-13(18)9-11/h2-4,6,8-10,15,21H,5,7H2,1H3
InChIKeyVLJISSAHVBKOTQ-UHFFFAOYSA-N
MW339.22 g/mol
LogP3.12
Rot. Bonds5

About 2-(3,5-dichlorophenyl)-2-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)acetamide

2-(3,5-dichlorophenyl)-2-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)acetamide (PubChem CID 75436856) has the molecular formula C16H16Cl2N2O2 and a molecular weight of 339.22 g/mol. Its IUPAC name is 2-(3,5-dichlorophenyl)-2-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)acetamide.

Molecular Properties

Compound Name2-(3,5-dichlorophenyl)-2-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)acetamide
PubChem CID75436856
Molecular FormulaC16H16Cl2N2O2
Molecular Weight339.22 g/mol
Exact Mass338.06
IUPAC Name2-(3,5-dichlorophenyl)-2-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)acetamide
SMILESCN(CCc1ccccn1)C(=O)C(O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C16H16Cl2N2O2/c1-20(7-5-14-4-2-3-6-19-14)16(22)15(21)11-8-12(17)10-13(18)9-11/h2-4,6,8-10,15,21H,5,7H2,1H3
InChIKeyVLJISSAHVBKOTQ-UHFFFAOYSA-N
XLogP3.12
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.22
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dichlorophenyl)-2-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)acetamide?
The IUPAC name of 2-(3,5-dichlorophenyl)-2-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)acetamide (CID 75436856) is 2-(3,5-dichlorophenyl)-2-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)acetamide.
What is the SMILES notation for 2-(3,5-dichlorophenyl)-2-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)acetamide?
The canonical SMILES for 2-(3,5-dichlorophenyl)-2-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)acetamide is CN(CCc1ccccn1)C(=O)C(O)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 2-(3,5-dichlorophenyl)-2-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)acetamide?
The InChIKey is VLJISSAHVBKOTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N2O2/c1-20(7-5-14-4-2-3-6-19-14)16(22)15(21)11-8-12(17)10-13(18)9-11/h2-4,6,8-10,15,21H,5,7H2,1H3.
What are the key properties of 2-(3,5-dichlorophenyl)-2-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)acetamide?
2-(3,5-dichlorophenyl)-2-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)acetamide has a molecular weight of 339.22 g/mol, XLogP of 3.12, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dichlorophenyl)-2-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)acetamide is sourced from PubChem (CID 75436856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).