2-(2-chloro-6-fluorophenyl)-N-(2-morpholin-4-ylethyl)acetamide

C14H18ClFN2O2 — CID 1094119

IUPAC2-(2-chloro-6-fluorophenyl)-N-(2-morpholin-4-ylethyl)acetamide
SMILESO=C(Cc1c(F)cccc1Cl)NCCN1CCOCC1
InChIInChI=1S/C14H18ClFN2O2/c15-12-2-1-3-13(16)11(12)10-14(19)17-4-5-18-6-8-20-9-7-18/h1-3H,4-10H2,(H,17,19)
InChIKeyBFXLDZOHXULEJL-UHFFFAOYSA-N
MW300.76 g/mol
LogP1.47
Rot. Bonds5

About 2-(2-chloro-6-fluorophenyl)-N-(2-morpholin-4-ylethyl)acetamide

2-(2-chloro-6-fluorophenyl)-N-(2-morpholin-4-ylethyl)acetamide (PubChem CID 1094119) has the molecular formula C14H18ClFN2O2 and a molecular weight of 300.76 g/mol. Its IUPAC name is 2-(2-chloro-6-fluorophenyl)-N-(2-morpholin-4-ylethyl)acetamide.

Molecular Properties

Compound Name2-(2-chloro-6-fluorophenyl)-N-(2-morpholin-4-ylethyl)acetamide
PubChem CID1094119
Molecular FormulaC14H18ClFN2O2
Molecular Weight300.76 g/mol
Exact Mass300.10
IUPAC Name2-(2-chloro-6-fluorophenyl)-N-(2-morpholin-4-ylethyl)acetamide
SMILESO=C(Cc1c(F)cccc1Cl)NCCN1CCOCC1
InChIInChI=1S/C14H18ClFN2O2/c15-12-2-1-3-13(16)11(12)10-14(19)17-4-5-18-6-8-20-9-7-18/h1-3H,4-10H2,(H,17,19)
InChIKeyBFXLDZOHXULEJL-UHFFFAOYSA-N
XLogP1.47
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.76
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-fluorophenyl)-N-(2-morpholin-4-ylethyl)acetamide?
The IUPAC name of 2-(2-chloro-6-fluorophenyl)-N-(2-morpholin-4-ylethyl)acetamide (CID 1094119) is 2-(2-chloro-6-fluorophenyl)-N-(2-morpholin-4-ylethyl)acetamide.
What is the SMILES notation for 2-(2-chloro-6-fluorophenyl)-N-(2-morpholin-4-ylethyl)acetamide?
The canonical SMILES for 2-(2-chloro-6-fluorophenyl)-N-(2-morpholin-4-ylethyl)acetamide is O=C(Cc1c(F)cccc1Cl)NCCN1CCOCC1.
What is the InChIKey of 2-(2-chloro-6-fluorophenyl)-N-(2-morpholin-4-ylethyl)acetamide?
The InChIKey is BFXLDZOHXULEJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClFN2O2/c15-12-2-1-3-13(16)11(12)10-14(19)17-4-5-18-6-8-20-9-7-18/h1-3H,4-10H2,(H,17,19).
What are the key properties of 2-(2-chloro-6-fluorophenyl)-N-(2-morpholin-4-ylethyl)acetamide?
2-(2-chloro-6-fluorophenyl)-N-(2-morpholin-4-ylethyl)acetamide has a molecular weight of 300.76 g/mol, XLogP of 1.47, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-fluorophenyl)-N-(2-morpholin-4-ylethyl)acetamide is sourced from PubChem (CID 1094119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).