N-(3,5-dichloro-4-fluorophenyl)-2-(3-hydroxyphenyl)acetamide

C14H10Cl2FNO2 — CID 106511124

IUPACN-(3,5-dichloro-4-fluorophenyl)-2-(3-hydroxyphenyl)acetamide
SMILESO=C(Cc1cccc(O)c1)Nc1cc(Cl)c(F)c(Cl)c1
InChIInChI=1S/C14H10Cl2FNO2/c15-11-6-9(7-12(16)14(11)17)18-13(20)5-8-2-1-3-10(19)4-8/h1-4,6-7,19H,5H2,(H,18,20)
InChIKeySRBPGVBPVPFIRH-UHFFFAOYSA-N
MW314.14 g/mol
LogP4.02
Rot. Bonds3

About N-(3,5-dichloro-4-fluorophenyl)-2-(3-hydroxyphenyl)acetamide

N-(3,5-dichloro-4-fluorophenyl)-2-(3-hydroxyphenyl)acetamide (PubChem CID 106511124) has the molecular formula C14H10Cl2FNO2 and a molecular weight of 314.14 g/mol. Its IUPAC name is N-(3,5-dichloro-4-fluorophenyl)-2-(3-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-(3,5-dichloro-4-fluorophenyl)-2-(3-hydroxyphenyl)acetamide
PubChem CID106511124
Molecular FormulaC14H10Cl2FNO2
Molecular Weight314.14 g/mol
Exact Mass313.01
IUPAC NameN-(3,5-dichloro-4-fluorophenyl)-2-(3-hydroxyphenyl)acetamide
SMILESO=C(Cc1cccc(O)c1)Nc1cc(Cl)c(F)c(Cl)c1
InChIInChI=1S/C14H10Cl2FNO2/c15-11-6-9(7-12(16)14(11)17)18-13(20)5-8-2-1-3-10(19)4-8/h1-4,6-7,19H,5H2,(H,18,20)
InChIKeySRBPGVBPVPFIRH-UHFFFAOYSA-N
XLogP4.02
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.14
LogP ≤ 54.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Related Compounds

2-(3-aminophenyl)-N-(3,5-dichloro-4-fluorophenyl)acetamide
CID 107571211
N-(3-fluoro-5-methylphenyl)-2-(3-hydroxyphenyl)acetamide
CID 79049813
2-(3-hydroxyphenyl)-N-(4-hydroxyphenyl)acetamide
CID 61399458
N-(2,5-dichlorophenyl)-2-(3-hydroxyphenyl)acetamide
CID 61399999
2-(3-hydroxyphenyl)-N-(2,4,5-trichlorophenyl)acetamide
CID 61399936
N-(3,4-dihydroxyphenyl)-2-(3-hydroxyphenyl)acetamide
CID 67560299
N-[4-(aminomethyl)phenyl]-2-(3-hydroxyphenyl)acetamide
CID 61399107
N-(2,6-difluoro-3-methylphenyl)-2-(3-hydroxyphenyl)acetamide
CID 82819723
N-(3,5-dichloro-4-hydroxyphenyl)-2-(2,6-difluorophenyl)acetamide
CID 82880113
1-(3-chloro-2-fluorophenyl)-3-(3-hydroxyphenyl)propan-2-one
CID 82803396
N-(2,6-dichlorophenyl)-2-(3-fluorophenyl)acetamide
CID 92647585
N-(3-chloro-4-fluorophenyl)-2-phenylacetamide
CID 871803

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichloro-4-fluorophenyl)-2-(3-hydroxyphenyl)acetamide?
The IUPAC name of N-(3,5-dichloro-4-fluorophenyl)-2-(3-hydroxyphenyl)acetamide (CID 106511124) is N-(3,5-dichloro-4-fluorophenyl)-2-(3-hydroxyphenyl)acetamide.
What is the SMILES notation for N-(3,5-dichloro-4-fluorophenyl)-2-(3-hydroxyphenyl)acetamide?
The canonical SMILES for N-(3,5-dichloro-4-fluorophenyl)-2-(3-hydroxyphenyl)acetamide is O=C(Cc1cccc(O)c1)Nc1cc(Cl)c(F)c(Cl)c1.
What is the InChIKey of N-(3,5-dichloro-4-fluorophenyl)-2-(3-hydroxyphenyl)acetamide?
The InChIKey is SRBPGVBPVPFIRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2FNO2/c15-11-6-9(7-12(16)14(11)17)18-13(20)5-8-2-1-3-10(19)4-8/h1-4,6-7,19H,5H2,(H,18,20).
What are the key properties of N-(3,5-dichloro-4-fluorophenyl)-2-(3-hydroxyphenyl)acetamide?
N-(3,5-dichloro-4-fluorophenyl)-2-(3-hydroxyphenyl)acetamide has a molecular weight of 314.14 g/mol, XLogP of 4.02, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichloro-4-fluorophenyl)-2-(3-hydroxyphenyl)acetamide is sourced from PubChem (CID 106511124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).