2-(2-bromophenyl)-N-[2-(diethylamino)-2-oxoethyl]acetamide

C14H19BrN2O2 — CID 112994741

IUPAC2-(2-bromophenyl)-N-[2-(diethylamino)-2-oxoethyl]acetamide
SMILESCCN(CC)C(=O)CNC(=O)Cc1ccccc1Br
InChIInChI=1S/C14H19BrN2O2/c1-3-17(4-2)14(19)10-16-13(18)9-11-7-5-6-8-12(11)15/h5-8H,3-4,9-10H2,1-2H3,(H,16,18)
InChIKeyGDOZVIBLKHCENW-UHFFFAOYSA-N
MW327.22 g/mol
LogP1.98
Rot. Bonds6

About 2-(2-bromophenyl)-N-[2-(diethylamino)-2-oxoethyl]acetamide

2-(2-bromophenyl)-N-[2-(diethylamino)-2-oxoethyl]acetamide (PubChem CID 112994741) has the molecular formula C14H19BrN2O2 and a molecular weight of 327.22 g/mol. Its IUPAC name is 2-(2-bromophenyl)-N-[2-(diethylamino)-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-(2-bromophenyl)-N-[2-(diethylamino)-2-oxoethyl]acetamide
PubChem CID112994741
Molecular FormulaC14H19BrN2O2
Molecular Weight327.22 g/mol
Exact Mass326.06
IUPAC Name2-(2-bromophenyl)-N-[2-(diethylamino)-2-oxoethyl]acetamide
SMILESCCN(CC)C(=O)CNC(=O)Cc1ccccc1Br
InChIInChI=1S/C14H19BrN2O2/c1-3-17(4-2)14(19)10-16-13(18)9-11-7-5-6-8-12(11)15/h5-8H,3-4,9-10H2,1-2H3,(H,16,18)
InChIKeyGDOZVIBLKHCENW-UHFFFAOYSA-N
XLogP1.98
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.22
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-bromophenyl)-N-[2-(dipropylamino)-2-oxoethyl]acetamide
CID 112995770
2-[2-[[2-(diethylamino)-2-oxoethyl]amino]-2-oxoethyl]benzoic acid
CID 115923743
N-[2-[benzyl(methyl)amino]-2-oxoethyl]-2-(2-bromophenyl)acetamide
CID 112992422
N,N-diethyl-2-[(2-methylphenyl)methylamino]acetamide
CID 60695385
2-(2-bromophenyl)-N-pentylacetamide
CID 113098374
3-(2-bromophenyl)-N-[2-(dimethylamino)-2-oxoethyl]propanamide
CID 51085814
N-[(2-bromophenyl)methyl]-2-(dimethylamino)acetamide
CID 110479783
N-[(2-bromophenyl)methyl]acetamide
CID 2824953
2-(2-bromophenyl)-N-ethyl-N-prop-2-enylacetamide
CID 102276029
N-[2-(dipropylamino)-2-oxoethyl]-2-phenylacetamide
CID 78784642
3-[[2-[2-(aminomethyl)phenyl]acetyl]amino]-N,N-diethylpropanamide
CID 81311740
2-(2-bromophenyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 112990865

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)-N-[2-(diethylamino)-2-oxoethyl]acetamide?
The IUPAC name of 2-(2-bromophenyl)-N-[2-(diethylamino)-2-oxoethyl]acetamide (CID 112994741) is 2-(2-bromophenyl)-N-[2-(diethylamino)-2-oxoethyl]acetamide.
What is the SMILES notation for 2-(2-bromophenyl)-N-[2-(diethylamino)-2-oxoethyl]acetamide?
The canonical SMILES for 2-(2-bromophenyl)-N-[2-(diethylamino)-2-oxoethyl]acetamide is CCN(CC)C(=O)CNC(=O)Cc1ccccc1Br.
What is the InChIKey of 2-(2-bromophenyl)-N-[2-(diethylamino)-2-oxoethyl]acetamide?
The InChIKey is GDOZVIBLKHCENW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19BrN2O2/c1-3-17(4-2)14(19)10-16-13(18)9-11-7-5-6-8-12(11)15/h5-8H,3-4,9-10H2,1-2H3,(H,16,18).
What are the key properties of 2-(2-bromophenyl)-N-[2-(diethylamino)-2-oxoethyl]acetamide?
2-(2-bromophenyl)-N-[2-(diethylamino)-2-oxoethyl]acetamide has a molecular weight of 327.22 g/mol, XLogP of 1.98, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)-N-[2-(diethylamino)-2-oxoethyl]acetamide is sourced from PubChem (CID 112994741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).