2-(2,6-dichlorophenyl)-N-(2-hydroxynaphthalen-1-yl)acetamide

C18H13Cl2NO2 — CID 8797412

IUPAC2-(2,6-dichlorophenyl)-N-(2-hydroxynaphthalen-1-yl)acetamide
SMILESO=C(Cc1c(Cl)cccc1Cl)Nc1c(O)ccc2ccccc12
InChIInChI=1S/C18H13Cl2NO2/c19-14-6-3-7-15(20)13(14)10-17(23)21-18-12-5-2-1-4-11(12)8-9-16(18)22/h1-9,22H,10H2,(H,21,23)
InChIKeyYMTBSHKIKBGBJL-UHFFFAOYSA-N
MW346.21 g/mol
LogP5.03
Rot. Bonds3

About 2-(2,6-dichlorophenyl)-N-(2-hydroxynaphthalen-1-yl)acetamide

2-(2,6-dichlorophenyl)-N-(2-hydroxynaphthalen-1-yl)acetamide (PubChem CID 8797412) has the molecular formula C18H13Cl2NO2 and a molecular weight of 346.21 g/mol. Its IUPAC name is 2-(2,6-dichlorophenyl)-N-(2-hydroxynaphthalen-1-yl)acetamide.

Molecular Properties

Compound Name2-(2,6-dichlorophenyl)-N-(2-hydroxynaphthalen-1-yl)acetamide
PubChem CID8797412
Molecular FormulaC18H13Cl2NO2
Molecular Weight346.21 g/mol
Exact Mass345.03
IUPAC Name2-(2,6-dichlorophenyl)-N-(2-hydroxynaphthalen-1-yl)acetamide
SMILESO=C(Cc1c(Cl)cccc1Cl)Nc1c(O)ccc2ccccc12
InChIInChI=1S/C18H13Cl2NO2/c19-14-6-3-7-15(20)13(14)10-17(23)21-18-12-5-2-1-4-11(12)8-9-16(18)22/h1-9,22H,10H2,(H,21,23)
InChIKeyYMTBSHKIKBGBJL-UHFFFAOYSA-N
XLogP5.03
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.21
LogP ≤ 55.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichlorophenyl)-N-(2-hydroxynaphthalen-1-yl)acetamide?
The IUPAC name of 2-(2,6-dichlorophenyl)-N-(2-hydroxynaphthalen-1-yl)acetamide (CID 8797412) is 2-(2,6-dichlorophenyl)-N-(2-hydroxynaphthalen-1-yl)acetamide.
What is the SMILES notation for 2-(2,6-dichlorophenyl)-N-(2-hydroxynaphthalen-1-yl)acetamide?
The canonical SMILES for 2-(2,6-dichlorophenyl)-N-(2-hydroxynaphthalen-1-yl)acetamide is O=C(Cc1c(Cl)cccc1Cl)Nc1c(O)ccc2ccccc12.
What is the InChIKey of 2-(2,6-dichlorophenyl)-N-(2-hydroxynaphthalen-1-yl)acetamide?
The InChIKey is YMTBSHKIKBGBJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13Cl2NO2/c19-14-6-3-7-15(20)13(14)10-17(23)21-18-12-5-2-1-4-11(12)8-9-16(18)22/h1-9,22H,10H2,(H,21,23).
What are the key properties of 2-(2,6-dichlorophenyl)-N-(2-hydroxynaphthalen-1-yl)acetamide?
2-(2,6-dichlorophenyl)-N-(2-hydroxynaphthalen-1-yl)acetamide has a molecular weight of 346.21 g/mol, XLogP of 5.03, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichlorophenyl)-N-(2-hydroxynaphthalen-1-yl)acetamide is sourced from PubChem (CID 8797412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).