6-amino-N-(2,4-dibromophenyl)-4,4-dimethylhexanamide

C14H20Br2N2O — CID 65290987

IUPAC6-amino-N-(2,4-dibromophenyl)-4,4-dimethylhexanamide
SMILESCC(C)(CCN)CCC(=O)Nc1ccc(Br)cc1Br
InChIInChI=1S/C14H20Br2N2O/c1-14(2,7-8-17)6-5-13(19)18-12-4-3-10(15)9-11(12)16/h3-4,9H,5-8,17H2,1-2H3,(H,18,19)
InChIKeyHHJOCLCEJJXGMY-UHFFFAOYSA-N
MW392.14 g/mol
LogP4.31
Rot. Bonds6

About 6-amino-N-(2,4-dibromophenyl)-4,4-dimethylhexanamide

6-amino-N-(2,4-dibromophenyl)-4,4-dimethylhexanamide (PubChem CID 65290987) has the molecular formula C14H20Br2N2O and a molecular weight of 392.14 g/mol. Its IUPAC name is 6-amino-N-(2,4-dibromophenyl)-4,4-dimethylhexanamide.

Molecular Properties

Compound Name6-amino-N-(2,4-dibromophenyl)-4,4-dimethylhexanamide
PubChem CID65290987
Molecular FormulaC14H20Br2N2O
Molecular Weight392.14 g/mol
Exact Mass389.99
IUPAC Name6-amino-N-(2,4-dibromophenyl)-4,4-dimethylhexanamide
SMILESCC(C)(CCN)CCC(=O)Nc1ccc(Br)cc1Br
InChIInChI=1S/C14H20Br2N2O/c1-14(2,7-8-17)6-5-13(19)18-12-4-3-10(15)9-11(12)16/h3-4,9H,5-8,17H2,1-2H3,(H,18,19)
InChIKeyHHJOCLCEJJXGMY-UHFFFAOYSA-N
XLogP4.31
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.14
LogP ≤ 54.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-amino-4,4-dimethyl-N-(2,4,6-tribromophenyl)hexanamide
CID 65292805
tert-butyl 4-(2,4-dibromoanilino)-4-oxobutanoate
CID 106707168
N-(2,4-dibromophenyl)hexanamide
CID 4251482
4-[(6-amino-4,4-dimethylhexanoyl)amino]-3-chlorobenzoic acid
CID 65291054
6-amino-N-(2-hydroxy-4-methoxyphenyl)-4,4-dimethylhexanamide
CID 102695165
2-[2-aminoethyl(methyl)amino]-N-(2,4-dibromophenyl)acetamide
CID 62687733
2-(2-aminoethoxy)-N-(2,4-dibromophenyl)acetamide
CID 79473463
6-amino-N-(4-bromo-3-methoxyphenyl)-4,4-dimethylhexanamide
CID 82867638
3-(2,4-dibromoanilino)-3-oxopropanoic acid
CID 62230789
2-[(6-amino-4,4-dimethylhexanoyl)amino]benzoic acid
CID 65291915
6-amino-N-(4-fluoro-2-nitrophenyl)-4,4-dimethylhexanamide
CID 65290458
6-amino-4,4-dimethyl-N-phenylhexanamide
CID 65292724

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(2,4-dibromophenyl)-4,4-dimethylhexanamide?
The IUPAC name of 6-amino-N-(2,4-dibromophenyl)-4,4-dimethylhexanamide (CID 65290987) is 6-amino-N-(2,4-dibromophenyl)-4,4-dimethylhexanamide.
What is the SMILES notation for 6-amino-N-(2,4-dibromophenyl)-4,4-dimethylhexanamide?
The canonical SMILES for 6-amino-N-(2,4-dibromophenyl)-4,4-dimethylhexanamide is CC(C)(CCN)CCC(=O)Nc1ccc(Br)cc1Br.
What is the InChIKey of 6-amino-N-(2,4-dibromophenyl)-4,4-dimethylhexanamide?
The InChIKey is HHJOCLCEJJXGMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20Br2N2O/c1-14(2,7-8-17)6-5-13(19)18-12-4-3-10(15)9-11(12)16/h3-4,9H,5-8,17H2,1-2H3,(H,18,19).
What are the key properties of 6-amino-N-(2,4-dibromophenyl)-4,4-dimethylhexanamide?
6-amino-N-(2,4-dibromophenyl)-4,4-dimethylhexanamide has a molecular weight of 392.14 g/mol, XLogP of 4.31, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(2,4-dibromophenyl)-4,4-dimethylhexanamide is sourced from PubChem (CID 65290987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).