N-(3,4-dichlorophenyl)-2,2-difluoroacetamide

C8H5Cl2F2NO — CID 23273950

IUPACN-(3,4-dichlorophenyl)-2,2-difluoroacetamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)C(F)F
InChIInChI=1S/C8H5Cl2F2NO/c9-5-2-1-4(3-6(5)10)13-8(14)7(11)12/h1-3,7H,(H,13,14)
InChIKeyDHWSRBWKHLTMQD-UHFFFAOYSA-N
MW240.04 g/mol
LogP3.20
Rot. Bonds2

About N-(3,4-dichlorophenyl)-2,2-difluoroacetamide

N-(3,4-dichlorophenyl)-2,2-difluoroacetamide (PubChem CID 23273950) has the molecular formula C8H5Cl2F2NO and a molecular weight of 240.04 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-2,2-difluoroacetamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-2,2-difluoroacetamide
PubChem CID23273950
Molecular FormulaC8H5Cl2F2NO
Molecular Weight240.04 g/mol
Exact Mass238.97
IUPAC NameN-(3,4-dichlorophenyl)-2,2-difluoroacetamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)C(F)F
InChIInChI=1S/C8H5Cl2F2NO/c9-5-2-1-4(3-6(5)10)13-8(14)7(11)12/h1-3,7H,(H,13,14)
InChIKeyDHWSRBWKHLTMQD-UHFFFAOYSA-N
XLogP3.20
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.04
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-2,2-difluoroacetamide?
The IUPAC name of N-(3,4-dichlorophenyl)-2,2-difluoroacetamide (CID 23273950) is N-(3,4-dichlorophenyl)-2,2-difluoroacetamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-2,2-difluoroacetamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-2,2-difluoroacetamide is O=C(Nc1ccc(Cl)c(Cl)c1)C(F)F.
What is the InChIKey of N-(3,4-dichlorophenyl)-2,2-difluoroacetamide?
The InChIKey is DHWSRBWKHLTMQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5Cl2F2NO/c9-5-2-1-4(3-6(5)10)13-8(14)7(11)12/h1-3,7H,(H,13,14).
What are the key properties of N-(3,4-dichlorophenyl)-2,2-difluoroacetamide?
N-(3,4-dichlorophenyl)-2,2-difluoroacetamide has a molecular weight of 240.04 g/mol, XLogP of 3.20, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-2,2-difluoroacetamide is sourced from PubChem (CID 23273950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).