2-(2-bromophenyl)-2-[2-(diethylamino)ethylamino]acetamide

C14H22BrN3O — CID 54941562

IUPAC2-(2-bromophenyl)-2-[2-(diethylamino)ethylamino]acetamide
SMILESCCN(CC)CCNC(C(N)=O)c1ccccc1Br
InChIInChI=1S/C14H22BrN3O/c1-3-18(4-2)10-9-17-13(14(16)19)11-7-5-6-8-12(11)15/h5-8,13,17H,3-4,9-10H2,1-2H3,(H2,16,19)
InChIKeyAIJUIWNTLRQHED-UHFFFAOYSA-N
MW328.25 g/mol
LogP1.91
Rot. Bonds8

About 2-(2-bromophenyl)-2-[2-(diethylamino)ethylamino]acetamide

2-(2-bromophenyl)-2-[2-(diethylamino)ethylamino]acetamide (PubChem CID 54941562) has the molecular formula C14H22BrN3O and a molecular weight of 328.25 g/mol. Its IUPAC name is 2-(2-bromophenyl)-2-[2-(diethylamino)ethylamino]acetamide.

Molecular Properties

Compound Name2-(2-bromophenyl)-2-[2-(diethylamino)ethylamino]acetamide
PubChem CID54941562
Molecular FormulaC14H22BrN3O
Molecular Weight328.25 g/mol
Exact Mass327.09
IUPAC Name2-(2-bromophenyl)-2-[2-(diethylamino)ethylamino]acetamide
SMILESCCN(CC)CCNC(C(N)=O)c1ccccc1Br
InChIInChI=1S/C14H22BrN3O/c1-3-18(4-2)10-9-17-13(14(16)19)11-7-5-6-8-12(11)15/h5-8,13,17H,3-4,9-10H2,1-2H3,(H2,16,19)
InChIKeyAIJUIWNTLRQHED-UHFFFAOYSA-N
XLogP1.91
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.25
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(diethylamino)ethylamino]-2-(2-hydroxyphenyl)acetamide
CID 116684899
2-(3-bromo-4-chlorophenyl)-2-[2-(diethylamino)ethylamino]acetamide
CID 83230961
2-(4-bromo-5-chlorothiophen-2-yl)-2-[2-(diethylamino)ethylamino]acetamide
CID 102840263
2-(benzylamino)-2-(2-bromophenyl)acetamide
CID 54889282
2-(3-bromo-4-methoxyphenyl)-2-[2-(diethylamino)ethylamino]acetamide
CID 61036831
ethyl 2-[2-(diethylamino)ethylamino]-2-(2-fluorophenyl)acetate
CID 60994518
2-[2-(dimethylamino)ethylamino]-2-(2-hydroxyphenyl)acetamide
CID 116684905
2-(2-chlorophenyl)-2-[2-(diethylamino)ethylamino]acetic acid
CID 54890478
ethyl 2-(2-chlorophenyl)-2-[2-(diethylamino)ethylamino]acetate
CID 60994243
2-(2-bromophenyl)-2-(cyclopropylmethylamino)acetamide
CID 60996640
2-[2-(diethylamino)ethylamino]-2-(1,5-dimethylpyrazol-4-yl)acetamide
CID 79584534
2-(2-bromophenyl)-2-(butylamino)acetic acid
CID 84747018

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)-2-[2-(diethylamino)ethylamino]acetamide?
The IUPAC name of 2-(2-bromophenyl)-2-[2-(diethylamino)ethylamino]acetamide (CID 54941562) is 2-(2-bromophenyl)-2-[2-(diethylamino)ethylamino]acetamide.
What is the SMILES notation for 2-(2-bromophenyl)-2-[2-(diethylamino)ethylamino]acetamide?
The canonical SMILES for 2-(2-bromophenyl)-2-[2-(diethylamino)ethylamino]acetamide is CCN(CC)CCNC(C(N)=O)c1ccccc1Br.
What is the InChIKey of 2-(2-bromophenyl)-2-[2-(diethylamino)ethylamino]acetamide?
The InChIKey is AIJUIWNTLRQHED-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22BrN3O/c1-3-18(4-2)10-9-17-13(14(16)19)11-7-5-6-8-12(11)15/h5-8,13,17H,3-4,9-10H2,1-2H3,(H2,16,19).
What are the key properties of 2-(2-bromophenyl)-2-[2-(diethylamino)ethylamino]acetamide?
2-(2-bromophenyl)-2-[2-(diethylamino)ethylamino]acetamide has a molecular weight of 328.25 g/mol, XLogP of 1.91, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)-2-[2-(diethylamino)ethylamino]acetamide is sourced from PubChem (CID 54941562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).