2-(4-bromophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide

C14H17BrN2O3 — CID 110712388

IUPAC2-(4-bromophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide
SMILESO=C(Cc1ccc(Br)cc1)NCC(=O)N1CCOCC1
InChIInChI=1S/C14H17BrN2O3/c15-12-3-1-11(2-4-12)9-13(18)16-10-14(19)17-5-7-20-8-6-17/h1-4H,5-10H2,(H,16,18)
InChIKeyCPDYQMCRHHPRKO-UHFFFAOYSA-N
MW341.20 g/mol
LogP0.97
Rot. Bonds4

About 2-(4-bromophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide

2-(4-bromophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide (PubChem CID 110712388) has the molecular formula C14H17BrN2O3 and a molecular weight of 341.20 g/mol. Its IUPAC name is 2-(4-bromophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide.

Molecular Properties

Compound Name2-(4-bromophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide
PubChem CID110712388
Molecular FormulaC14H17BrN2O3
Molecular Weight341.20 g/mol
Exact Mass340.04
IUPAC Name2-(4-bromophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide
SMILESO=C(Cc1ccc(Br)cc1)NCC(=O)N1CCOCC1
InChIInChI=1S/C14H17BrN2O3/c15-12-3-1-11(2-4-12)9-13(18)16-10-14(19)17-5-7-20-8-6-17/h1-4H,5-10H2,(H,16,18)
InChIKeyCPDYQMCRHHPRKO-UHFFFAOYSA-N
XLogP0.97
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.20
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-ethylphenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide
CID 75445681
2-(4-methylphenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide
CID 110712382
2-(4-bromophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide
CID 110712327
N-(3-morpholin-4-yl-3-oxopropyl)-2-phenylacetamide
CID 29418767
2-morpholin-4-yl-N-(2-morpholin-4-yl-2-oxoethyl)acetamide
CID 86019043
3-bromo-N-(2-morpholin-4-yl-2-oxoethyl)pyridine-2-carboxamide
CID 166178525
2-(3-bromophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide
CID 112990956
4-bromo-N-(2-morpholin-4-yl-2-oxoethyl)thiophene-3-carboxamide
CID 146086530
3-(2-fluorophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)propanamide
CID 110712379
N-(2-morpholin-4-yl-2-oxoethyl)-3-thiophen-3-ylpropanamide
CID 84596800
2-(4-methoxyphenyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 110712460
2-(4-bromophenyl)sulfanyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 51321713

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide?
The IUPAC name of 2-(4-bromophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide (CID 110712388) is 2-(4-bromophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide.
What is the SMILES notation for 2-(4-bromophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide?
The canonical SMILES for 2-(4-bromophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide is O=C(Cc1ccc(Br)cc1)NCC(=O)N1CCOCC1.
What is the InChIKey of 2-(4-bromophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide?
The InChIKey is CPDYQMCRHHPRKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17BrN2O3/c15-12-3-1-11(2-4-12)9-13(18)16-10-14(19)17-5-7-20-8-6-17/h1-4H,5-10H2,(H,16,18).
What are the key properties of 2-(4-bromophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide?
2-(4-bromophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide has a molecular weight of 341.20 g/mol, XLogP of 0.97, 4 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-yl-2-oxoethyl)acetamide is sourced from PubChem (CID 110712388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).