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

C14H19BrN2O3 — CID 888119

IUPAC2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)acetamide
SMILESO=C(COc1ccc(Br)cc1)NCCN1CCOCC1
InChIInChI=1S/C14H19BrN2O3/c15-12-1-3-13(4-2-12)20-11-14(18)16-5-6-17-7-9-19-10-8-17/h1-4H,5-11H2,(H,16,18)
InChIKeyGUBZVKLAYYMGNB-UHFFFAOYSA-N
MW343.22 g/mol
LogP1.28
Rot. Bonds6

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

2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)acetamide (PubChem CID 888119) has the molecular formula C14H19BrN2O3 and a molecular weight of 343.22 g/mol. Its IUPAC name is 2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)acetamide.

Molecular Properties

Compound Name2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)acetamide
PubChem CID888119
Molecular FormulaC14H19BrN2O3
Molecular Weight343.22 g/mol
Exact Mass342.06
IUPAC Name2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)acetamide
SMILESO=C(COc1ccc(Br)cc1)NCCN1CCOCC1
InChIInChI=1S/C14H19BrN2O3/c15-12-1-3-13(4-2-12)20-11-14(18)16-5-6-17-7-9-19-10-8-17/h1-4H,5-11H2,(H,16,18)
InChIKeyGUBZVKLAYYMGNB-UHFFFAOYSA-N
XLogP1.28
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.22
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-bromophenoxy)-N-(2-morpholin-4-ylethyl)acetamide
CID 47100694
2-(4-bromo-2-fluorophenoxy)-N-(2-morpholin-4-ylethyl)acetamide
CID 51159372
2-(2-bromophenoxy)-N-(2-morpholin-4-ylethyl)acetamide
CID 112977303
2-(3-chloro-4-fluorophenoxy)-N-(2-morpholin-4-ylethyl)acetamide
CID 134002654
(2R)-2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)propanamide
CID 2203701
4-bromo-N-[3-(2-morpholin-4-ylethylamino)-3-oxopropyl]benzamide
CID 26697005
2-(2,6-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide
CID 18892490
2-(2-methoxyphenoxy)-N-(2-morpholin-4-ylethyl)acetamide
CID 806992
2-(4-bromophenoxy)-N-(3-methyl-2-morpholin-4-ylbutyl)acetamide
CID 18153802
4-[3-(4-bromophenoxy)propyl]morpholine;oxalic acid
CID 2843796
2-[4-[methyl-(4-methylphenyl)sulfonylamino]phenoxy]-N-(2-morpholin-4-ylethyl)acetamide
CID 17247264
2-(4-ethyl-2-oxochromen-7-yl)oxy-N-(2-morpholin-4-ylethyl)acetamide
CID 4904447

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)acetamide?
The IUPAC name of 2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)acetamide (CID 888119) is 2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)acetamide.
What is the SMILES notation for 2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)acetamide?
The canonical SMILES for 2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)acetamide is O=C(COc1ccc(Br)cc1)NCCN1CCOCC1.
What is the InChIKey of 2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)acetamide?
The InChIKey is GUBZVKLAYYMGNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19BrN2O3/c15-12-1-3-13(4-2-12)20-11-14(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-bromophenoxy)-N-(2-morpholin-4-ylethyl)acetamide?
2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)acetamide has a molecular weight of 343.22 g/mol, XLogP of 1.28, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenoxy)-N-(2-morpholin-4-ylethyl)acetamide is sourced from PubChem (CID 888119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).