2-(2,6-dichloroanilino)-N-[(2-fluorophenyl)methyl]acetamide

C15H13Cl2FN2O — CID 108997690

IUPAC2-(2,6-dichloroanilino)-N-[(2-fluorophenyl)methyl]acetamide
SMILESO=C(CNc1c(Cl)cccc1Cl)NCc1ccccc1F
InChIInChI=1S/C15H13Cl2FN2O/c16-11-5-3-6-12(17)15(11)20-9-14(21)19-8-10-4-1-2-7-13(10)18/h1-7,20H,8-9H2,(H,19,21)
InChIKeyGVSILZLLHXANJR-UHFFFAOYSA-N
MW327.19 g/mol
LogP3.86
Rot. Bonds5

About 2-(2,6-dichloroanilino)-N-[(2-fluorophenyl)methyl]acetamide

2-(2,6-dichloroanilino)-N-[(2-fluorophenyl)methyl]acetamide (PubChem CID 108997690) has the molecular formula C15H13Cl2FN2O and a molecular weight of 327.19 g/mol. Its IUPAC name is 2-(2,6-dichloroanilino)-N-[(2-fluorophenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(2,6-dichloroanilino)-N-[(2-fluorophenyl)methyl]acetamide
PubChem CID108997690
Molecular FormulaC15H13Cl2FN2O
Molecular Weight327.19 g/mol
Exact Mass326.04
IUPAC Name2-(2,6-dichloroanilino)-N-[(2-fluorophenyl)methyl]acetamide
SMILESO=C(CNc1c(Cl)cccc1Cl)NCc1ccccc1F
InChIInChI=1S/C15H13Cl2FN2O/c16-11-5-3-6-12(17)15(11)20-9-14(21)19-8-10-4-1-2-7-13(10)18/h1-7,20H,8-9H2,(H,19,21)
InChIKeyGVSILZLLHXANJR-UHFFFAOYSA-N
XLogP3.86
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.19
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,6-dichloroanilino)-N-(2,6-difluorophenyl)acetamide
CID 65498988
2,6-dichloro-N-[(2-fluorophenyl)methyl]aniline
CID 65469329
1-(2,6-dichlorophenyl)-3-[(2-fluorophenyl)methyl]urea
CID 108897575
2-(3-fluoroanilino)-N-[(2-fluorophenyl)methyl]acetamide
CID 31665741
N-[(2-chlorophenyl)methyl]-3-(2,6-difluoroanilino)propanamide
CID 109021465
2-(2-chloro-6-fluoroanilino)-N-(2,2,2-trifluoroethyl)acetamide
CID 113423474
2-[(4-chlorophenyl)methylamino]-N-[(2-fluorophenyl)methyl]acetamide
CID 50981009
2-acetamido-N-[(2-fluorophenyl)methyl]acetamide
CID 110686999
2-chloro-N-[(2-fluorophenyl)methyl]benzamide
CID 5082380
N'-(2,3-dichlorophenyl)-N-[(2-fluorophenyl)methyl]propanediamide
CID 108946354
2-(4-chloroanilino)-N-[(2-chlorophenyl)methyl]acetamide
CID 26417208
2-(3,5-dimethylanilino)-N-[(2-fluorophenyl)methyl]acetamide
CID 51225001

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichloroanilino)-N-[(2-fluorophenyl)methyl]acetamide?
The IUPAC name of 2-(2,6-dichloroanilino)-N-[(2-fluorophenyl)methyl]acetamide (CID 108997690) is 2-(2,6-dichloroanilino)-N-[(2-fluorophenyl)methyl]acetamide.
What is the SMILES notation for 2-(2,6-dichloroanilino)-N-[(2-fluorophenyl)methyl]acetamide?
The canonical SMILES for 2-(2,6-dichloroanilino)-N-[(2-fluorophenyl)methyl]acetamide is O=C(CNc1c(Cl)cccc1Cl)NCc1ccccc1F.
What is the InChIKey of 2-(2,6-dichloroanilino)-N-[(2-fluorophenyl)methyl]acetamide?
The InChIKey is GVSILZLLHXANJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2FN2O/c16-11-5-3-6-12(17)15(11)20-9-14(21)19-8-10-4-1-2-7-13(10)18/h1-7,20H,8-9H2,(H,19,21).
What are the key properties of 2-(2,6-dichloroanilino)-N-[(2-fluorophenyl)methyl]acetamide?
2-(2,6-dichloroanilino)-N-[(2-fluorophenyl)methyl]acetamide has a molecular weight of 327.19 g/mol, XLogP of 3.86, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichloroanilino)-N-[(2-fluorophenyl)methyl]acetamide is sourced from PubChem (CID 108997690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).