2-[butyl(2-hydroxyethyl)amino]-N-(2,4-dibromophenyl)acetamide

C14H20Br2N2O2 — CID 60689148

IUPAC2-[butyl(2-hydroxyethyl)amino]-N-(2,4-dibromophenyl)acetamide
SMILESCCCCN(CCO)CC(=O)Nc1ccc(Br)cc1Br
InChIInChI=1S/C14H20Br2N2O2/c1-2-3-6-18(7-8-19)10-14(20)17-13-5-4-11(15)9-12(13)16/h4-5,9,19H,2-3,6-8,10H2,1H3,(H,17,20)
InChIKeyQYDIZBMOWKOHCQ-UHFFFAOYSA-N
MW408.13 g/mol
LogP3.24
Rot. Bonds8

About 2-[butyl(2-hydroxyethyl)amino]-N-(2,4-dibromophenyl)acetamide

2-[butyl(2-hydroxyethyl)amino]-N-(2,4-dibromophenyl)acetamide (PubChem CID 60689148) has the molecular formula C14H20Br2N2O2 and a molecular weight of 408.13 g/mol. Its IUPAC name is 2-[butyl(2-hydroxyethyl)amino]-N-(2,4-dibromophenyl)acetamide.

Molecular Properties

Compound Name2-[butyl(2-hydroxyethyl)amino]-N-(2,4-dibromophenyl)acetamide
PubChem CID60689148
Molecular FormulaC14H20Br2N2O2
Molecular Weight408.13 g/mol
Exact Mass405.99
IUPAC Name2-[butyl(2-hydroxyethyl)amino]-N-(2,4-dibromophenyl)acetamide
SMILESCCCCN(CCO)CC(=O)Nc1ccc(Br)cc1Br
InChIInChI=1S/C14H20Br2N2O2/c1-2-3-6-18(7-8-19)10-14(20)17-13-5-4-11(15)9-12(13)16/h4-5,9,19H,2-3,6-8,10H2,1H3,(H,17,20)
InChIKeyQYDIZBMOWKOHCQ-UHFFFAOYSA-N
XLogP3.24
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.13
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-bromo-2-methylphenyl)-2-[ethyl(2-hydroxyethyl)amino]acetamide
CID 31994430
N-(4-amino-2-methylphenyl)-2-[butyl(2-hydroxyethyl)amino]acetamide
CID 61444232
N-(2,4-dibromophenyl)hexanamide
CID 4251482
2-[butyl(2-hydroxyethyl)amino]-N-(2-methylphenyl)acetamide
CID 60688995
2-[butyl(2-hydroxyethyl)amino]-N-(2-iodophenyl)acetamide
CID 60689127
2-[butyl(2-hydroxyethyl)amino]-N-(5-fluoro-2-methylphenyl)acetamide
CID 60689165
N-(2,4-dibromophenyl)-2-[1-hydroxypropan-2-yl(methyl)amino]acetamide
CID 112548617
2-[butyl(2-hydroxyethyl)amino]-N-(2,3-dichlorophenyl)acetamide
CID 60689184
N-(3-bromophenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
CID 60692729
2-[2-aminoethyl(methyl)amino]-N-(2,4-dibromophenyl)acetamide
CID 62687733
2-(dibutylamino)-N-(2,4-dichlorophenyl)acetamide
CID 18870877
N-(2,4-dibromophenyl)-2-[3-hydroxybutyl(methyl)amino]acetamide
CID 115666901

Frequently Asked Questions

What is the IUPAC name of 2-[butyl(2-hydroxyethyl)amino]-N-(2,4-dibromophenyl)acetamide?
The IUPAC name of 2-[butyl(2-hydroxyethyl)amino]-N-(2,4-dibromophenyl)acetamide (CID 60689148) is 2-[butyl(2-hydroxyethyl)amino]-N-(2,4-dibromophenyl)acetamide.
What is the SMILES notation for 2-[butyl(2-hydroxyethyl)amino]-N-(2,4-dibromophenyl)acetamide?
The canonical SMILES for 2-[butyl(2-hydroxyethyl)amino]-N-(2,4-dibromophenyl)acetamide is CCCCN(CCO)CC(=O)Nc1ccc(Br)cc1Br.
What is the InChIKey of 2-[butyl(2-hydroxyethyl)amino]-N-(2,4-dibromophenyl)acetamide?
The InChIKey is QYDIZBMOWKOHCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20Br2N2O2/c1-2-3-6-18(7-8-19)10-14(20)17-13-5-4-11(15)9-12(13)16/h4-5,9,19H,2-3,6-8,10H2,1H3,(H,17,20).
What are the key properties of 2-[butyl(2-hydroxyethyl)amino]-N-(2,4-dibromophenyl)acetamide?
2-[butyl(2-hydroxyethyl)amino]-N-(2,4-dibromophenyl)acetamide has a molecular weight of 408.13 g/mol, XLogP of 3.24, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[butyl(2-hydroxyethyl)amino]-N-(2,4-dibromophenyl)acetamide is sourced from PubChem (CID 60689148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).