N-(3-bromophenyl)-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide

C15H24BrN3O — CID 28572652

IUPACN-(3-bromophenyl)-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide
SMILESCN(C)CC(C)(C)CNCC(=O)Nc1cccc(Br)c1
InChIInChI=1S/C15H24BrN3O/c1-15(2,11-19(3)4)10-17-9-14(20)18-13-7-5-6-12(16)8-13/h5-8,17H,9-11H2,1-4H3,(H,18,20)
InChIKeyRDJOOXOMJPSMGA-UHFFFAOYSA-N
MW342.28 g/mol
LogP2.57
Rot. Bonds7

About N-(3-bromophenyl)-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide

N-(3-bromophenyl)-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide (PubChem CID 28572652) has the molecular formula C15H24BrN3O and a molecular weight of 342.28 g/mol. Its IUPAC name is N-(3-bromophenyl)-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide.

Molecular Properties

Compound NameN-(3-bromophenyl)-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide
PubChem CID28572652
Molecular FormulaC15H24BrN3O
Molecular Weight342.28 g/mol
Exact Mass341.11
IUPAC NameN-(3-bromophenyl)-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide
SMILESCN(C)CC(C)(C)CNCC(=O)Nc1cccc(Br)c1
InChIInChI=1S/C15H24BrN3O/c1-15(2,11-19(3)4)10-17-9-14(20)18-13-7-5-6-12(16)8-13/h5-8,17H,9-11H2,1-4H3,(H,18,20)
InChIKeyRDJOOXOMJPSMGA-UHFFFAOYSA-N
XLogP2.57
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.28
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(3-methylphenyl)acetamide
CID 28572661
N-(3-bromophenyl)-2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]acetamide
CID 106147607
N-(3-bromophenyl)-2-[(3-hydroxy-2,2-dimethylpropyl)amino]acetamide
CID 113293844
2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-phenylacetamide
CID 28572618
N-(3-bromophenyl)-2-[(2-hydroxy-2,4-dimethylpentyl)amino]acetamide
CID 66178826
2-(4-bromoanilino)-N-(3-bromophenyl)acetamide
CID 7492464
N-(3-bromophenyl)-2-(2-methylprop-2-enylamino)acetamide
CID 115745377
N-(3-bromophenyl)-3,3-dimethylbutanamide
CID 842233
N-(3-bromophenyl)-2-[2-[cyclopropyl(methyl)amino]ethylamino]acetamide
CID 62976482
N-(3-bromophenyl)-2-(3-methylbutylamino)acetamide
CID 28576518
N-(3-chlorophenyl)-2-(2,2-dimethylpropylamino)acetamide
CID 61168620
N-(3-bromophenyl)-2-(2-methylbutylamino)acetamide
CID 62693083

Frequently Asked Questions

What is the IUPAC name of N-(3-bromophenyl)-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide?
The IUPAC name of N-(3-bromophenyl)-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide (CID 28572652) is N-(3-bromophenyl)-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide.
What is the SMILES notation for N-(3-bromophenyl)-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide?
The canonical SMILES for N-(3-bromophenyl)-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide is CN(C)CC(C)(C)CNCC(=O)Nc1cccc(Br)c1.
What is the InChIKey of N-(3-bromophenyl)-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide?
The InChIKey is RDJOOXOMJPSMGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24BrN3O/c1-15(2,11-19(3)4)10-17-9-14(20)18-13-7-5-6-12(16)8-13/h5-8,17H,9-11H2,1-4H3,(H,18,20).
What are the key properties of N-(3-bromophenyl)-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide?
N-(3-bromophenyl)-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide has a molecular weight of 342.28 g/mol, XLogP of 2.57, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromophenyl)-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide is sourced from PubChem (CID 28572652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).