2-(4-bromophenyl)-N-(2-morpholin-4-ylethyl)acetamide

C14H19BrN2O2 — CID 669924

IUPAC2-(4-bromophenyl)-N-(2-morpholin-4-ylethyl)acetamide
SMILESO=C(Cc1ccc(Br)cc1)NCCN1CCOCC1
InChIInChI=1S/C14H19BrN2O2/c15-13-3-1-12(2-4-13)11-14(18)16-5-6-17-7-9-19-10-8-17/h1-4H,5-11H2,(H,16,18)
InChIKeyCOZFTCFGVJQXID-UHFFFAOYSA-N
MW327.22 g/mol
LogP1.44
Rot. Bonds5

About 2-(4-bromophenyl)-N-(2-morpholin-4-ylethyl)acetamide

2-(4-bromophenyl)-N-(2-morpholin-4-ylethyl)acetamide (PubChem CID 669924) has the molecular formula C14H19BrN2O2 and a molecular weight of 327.22 g/mol. Its IUPAC name is 2-(4-bromophenyl)-N-(2-morpholin-4-ylethyl)acetamide.

Molecular Properties

Compound Name2-(4-bromophenyl)-N-(2-morpholin-4-ylethyl)acetamide
PubChem CID669924
Molecular FormulaC14H19BrN2O2
Molecular Weight327.22 g/mol
Exact Mass326.06
IUPAC Name2-(4-bromophenyl)-N-(2-morpholin-4-ylethyl)acetamide
SMILESO=C(Cc1ccc(Br)cc1)NCCN1CCOCC1
InChIInChI=1S/C14H19BrN2O2/c15-13-3-1-12(2-4-13)11-14(18)16-5-6-17-7-9-19-10-8-17/h1-4H,5-11H2,(H,16,18)
InChIKeyCOZFTCFGVJQXID-UHFFFAOYSA-N
XLogP1.44
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.22
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-N-(2-morpholin-4-ylethyl)acetamide?
The IUPAC name of 2-(4-bromophenyl)-N-(2-morpholin-4-ylethyl)acetamide (CID 669924) is 2-(4-bromophenyl)-N-(2-morpholin-4-ylethyl)acetamide.
What is the SMILES notation for 2-(4-bromophenyl)-N-(2-morpholin-4-ylethyl)acetamide?
The canonical SMILES for 2-(4-bromophenyl)-N-(2-morpholin-4-ylethyl)acetamide is O=C(Cc1ccc(Br)cc1)NCCN1CCOCC1.
What is the InChIKey of 2-(4-bromophenyl)-N-(2-morpholin-4-ylethyl)acetamide?
The InChIKey is COZFTCFGVJQXID-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19BrN2O2/c15-13-3-1-12(2-4-13)11-14(18)16-5-6-17-7-9-19-10-8-17/h1-4H,5-11H2,(H,16,18).
What are the key properties of 2-(4-bromophenyl)-N-(2-morpholin-4-ylethyl)acetamide?
2-(4-bromophenyl)-N-(2-morpholin-4-ylethyl)acetamide has a molecular weight of 327.22 g/mol, XLogP of 1.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-N-(2-morpholin-4-ylethyl)acetamide is sourced from PubChem (CID 669924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).