N-(1-amino-2,4-dimethylpentan-2-yl)-2,4-dibromobenzamide

C14H20Br2N2O — CID 107940162

IUPACN-(1-amino-2,4-dimethylpentan-2-yl)-2,4-dibromobenzamide
SMILESCC(C)CC(C)(CN)NC(=O)c1ccc(Br)cc1Br
InChIInChI=1S/C14H20Br2N2O/c1-9(2)7-14(3,8-17)18-13(19)11-5-4-10(15)6-12(11)16/h4-6,9H,7-8,17H2,1-3H3,(H,18,19)
InChIKeyDPFRTDSXIXSLTE-UHFFFAOYSA-N
MW392.14 g/mol
LogP3.70
Rot. Bonds5

About N-(1-amino-2,4-dimethylpentan-2-yl)-2,4-dibromobenzamide

N-(1-amino-2,4-dimethylpentan-2-yl)-2,4-dibromobenzamide (PubChem CID 107940162) has the molecular formula C14H20Br2N2O and a molecular weight of 392.14 g/mol. Its IUPAC name is N-(1-amino-2,4-dimethylpentan-2-yl)-2,4-dibromobenzamide.

Molecular Properties

Compound NameN-(1-amino-2,4-dimethylpentan-2-yl)-2,4-dibromobenzamide
PubChem CID107940162
Molecular FormulaC14H20Br2N2O
Molecular Weight392.14 g/mol
Exact Mass389.99
IUPAC NameN-(1-amino-2,4-dimethylpentan-2-yl)-2,4-dibromobenzamide
SMILESCC(C)CC(C)(CN)NC(=O)c1ccc(Br)cc1Br
InChIInChI=1S/C14H20Br2N2O/c1-9(2)7-14(3,8-17)18-13(19)11-5-4-10(15)6-12(11)16/h4-6,9H,7-8,17H2,1-3H3,(H,18,19)
InChIKeyDPFRTDSXIXSLTE-UHFFFAOYSA-N
XLogP3.70
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.14
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-amino-2,4-dimethylpentan-2-yl)-2-bromo-4-fluorobenzamide
CID 81486385
N-(1-amino-2,4-dimethylpentan-2-yl)-4-bromo-2-methylbenzamide;hydrochloride
CID 119598613
N-(1-amino-2,4-dimethylpentan-2-yl)-2-bromo-4-chlorobenzamide;hydrochloride
CID 119599263
N-(1-amino-2,4-dimethylpentan-2-yl)-5-bromo-2-hydroxybenzamide
CID 104872338
N-(1-amino-2,4-dimethylpentan-2-yl)-4-bromo-2-methoxybenzamide
CID 115369688
2,4-dibromo-N-(1,3-dihydroxy-2-methylpropan-2-yl)benzamide
CID 104920704
N-(1-amino-2,4-dimethylpentan-2-yl)-3-bromo-2-methylbenzamide
CID 81485460
N-(1-amino-2,4-dimethylpentan-2-yl)-2,5-dibromothiophene-3-carboxamide
CID 103807196
N-(1-amino-2,4-dimethylpentan-2-yl)-2-bromo-5-nitrobenzamide
CID 115309751
N-(1-amino-2,4-dimethylpentan-2-yl)-2,5-dihydroxybenzamide
CID 107725269
N-(1-amino-2,4-dimethylpentan-2-yl)-2-methylbenzamide
CID 81487529
N-(1-amino-2,4-dimethylpentan-2-yl)-4-bromo-3-fluorobenzamide;hydrochloride
CID 119597808

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2,4-dimethylpentan-2-yl)-2,4-dibromobenzamide?
The IUPAC name of N-(1-amino-2,4-dimethylpentan-2-yl)-2,4-dibromobenzamide (CID 107940162) is N-(1-amino-2,4-dimethylpentan-2-yl)-2,4-dibromobenzamide.
What is the SMILES notation for N-(1-amino-2,4-dimethylpentan-2-yl)-2,4-dibromobenzamide?
The canonical SMILES for N-(1-amino-2,4-dimethylpentan-2-yl)-2,4-dibromobenzamide is CC(C)CC(C)(CN)NC(=O)c1ccc(Br)cc1Br.
What is the InChIKey of N-(1-amino-2,4-dimethylpentan-2-yl)-2,4-dibromobenzamide?
The InChIKey is DPFRTDSXIXSLTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20Br2N2O/c1-9(2)7-14(3,8-17)18-13(19)11-5-4-10(15)6-12(11)16/h4-6,9H,7-8,17H2,1-3H3,(H,18,19).
What are the key properties of N-(1-amino-2,4-dimethylpentan-2-yl)-2,4-dibromobenzamide?
N-(1-amino-2,4-dimethylpentan-2-yl)-2,4-dibromobenzamide has a molecular weight of 392.14 g/mol, XLogP of 3.70, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2,4-dimethylpentan-2-yl)-2,4-dibromobenzamide is sourced from PubChem (CID 107940162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).