2,6-dichloro-N-[2-(4-fluorophenyl)ethyl]benzamide

C15H12Cl2FNO — CID 1122033

IUPAC2,6-dichloro-N-[2-(4-fluorophenyl)ethyl]benzamide
SMILESO=C(NCCc1ccc(F)cc1)c1c(Cl)cccc1Cl
InChIInChI=1S/C15H12Cl2FNO/c16-12-2-1-3-13(17)14(12)15(20)19-9-8-10-4-6-11(18)7-5-10/h1-7H,8-9H2,(H,19,20)
InChIKeyZQLLDOPRORIJFA-UHFFFAOYSA-N
MW312.17 g/mol
LogP4.11
Rot. Bonds4

About 2,6-dichloro-N-[2-(4-fluorophenyl)ethyl]benzamide

2,6-dichloro-N-[2-(4-fluorophenyl)ethyl]benzamide (PubChem CID 1122033) has the molecular formula C15H12Cl2FNO and a molecular weight of 312.17 g/mol. Its IUPAC name is 2,6-dichloro-N-[2-(4-fluorophenyl)ethyl]benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-[2-(4-fluorophenyl)ethyl]benzamide
PubChem CID1122033
Molecular FormulaC15H12Cl2FNO
Molecular Weight312.17 g/mol
Exact Mass311.03
IUPAC Name2,6-dichloro-N-[2-(4-fluorophenyl)ethyl]benzamide
SMILESO=C(NCCc1ccc(F)cc1)c1c(Cl)cccc1Cl
InChIInChI=1S/C15H12Cl2FNO/c16-12-2-1-3-13(17)14(12)15(20)19-9-8-10-4-6-11(18)7-5-10/h1-7H,8-9H2,(H,19,20)
InChIKeyZQLLDOPRORIJFA-UHFFFAOYSA-N
XLogP4.11
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.17
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,6-dichloro-N-[(4-fluorophenyl)methyl]benzamide
CID 841148
N-[2-(4-chlorophenyl)ethyl]-4-fluorobenzamide
CID 737426
5-chloro-N-[2-(4-fluorophenyl)ethyl]thiophene-2-carboxamide
CID 9392714
5-(2-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]furan-2-carboxamide
CID 9080736
5-(2-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]-3-methyl-1,2-oxazole-4-carboxamide
CID 46097141
N-[2-(4-chlorophenyl)ethyl]-2-(4-fluorophenyl)acetamide
CID 26516329
2,6-difluoro-N-[2-(4-hydroxyphenyl)ethyl]benzamide
CID 61017284
N-[2-[4-(azepan-1-ylsulfonyl)phenyl]ethyl]-2-chloro-6-fluorobenzamide
CID 108736474
2-[(2-chlorophenyl)methylamino]-N-[2-(4-fluorophenyl)ethyl]pyrimidine-5-carboxamide
CID 109257489
2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 94726162
N'-(2,3-dichlorophenyl)-N-[2-(4-fluorophenyl)ethyl]propanediamide
CID 108948495
2,3,6-trichloro-N-(2-phenylethyl)benzamide
CID 19171105

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[2-(4-fluorophenyl)ethyl]benzamide?
The IUPAC name of 2,6-dichloro-N-[2-(4-fluorophenyl)ethyl]benzamide (CID 1122033) is 2,6-dichloro-N-[2-(4-fluorophenyl)ethyl]benzamide.
What is the SMILES notation for 2,6-dichloro-N-[2-(4-fluorophenyl)ethyl]benzamide?
The canonical SMILES for 2,6-dichloro-N-[2-(4-fluorophenyl)ethyl]benzamide is O=C(NCCc1ccc(F)cc1)c1c(Cl)cccc1Cl.
What is the InChIKey of 2,6-dichloro-N-[2-(4-fluorophenyl)ethyl]benzamide?
The InChIKey is ZQLLDOPRORIJFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2FNO/c16-12-2-1-3-13(17)14(12)15(20)19-9-8-10-4-6-11(18)7-5-10/h1-7H,8-9H2,(H,19,20).
What are the key properties of 2,6-dichloro-N-[2-(4-fluorophenyl)ethyl]benzamide?
2,6-dichloro-N-[2-(4-fluorophenyl)ethyl]benzamide has a molecular weight of 312.17 g/mol, XLogP of 4.11, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-[2-(4-fluorophenyl)ethyl]benzamide is sourced from PubChem (CID 1122033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).