N-(2-amino-4-bromophenyl)nonanamide

C15H23BrN2O — CID 65449103

IUPACN-(2-amino-4-bromophenyl)nonanamide
SMILESCCCCCCCCC(=O)Nc1ccc(Br)cc1N
InChIInChI=1S/C15H23BrN2O/c1-2-3-4-5-6-7-8-15(19)18-14-10-9-12(16)11-13(14)17/h9-11H,2-8,17H2,1H3,(H,18,19)
InChIKeyPWHYUFOGOZVDTC-UHFFFAOYSA-N
MW327.27 g/mol
LogP4.72
Rot. Bonds8

About N-(2-amino-4-bromophenyl)nonanamide

N-(2-amino-4-bromophenyl)nonanamide (PubChem CID 65449103) has the molecular formula C15H23BrN2O and a molecular weight of 327.27 g/mol. Its IUPAC name is N-(2-amino-4-bromophenyl)nonanamide.

Molecular Properties

Compound NameN-(2-amino-4-bromophenyl)nonanamide
PubChem CID65449103
Molecular FormulaC15H23BrN2O
Molecular Weight327.27 g/mol
Exact Mass326.10
IUPAC NameN-(2-amino-4-bromophenyl)nonanamide
SMILESCCCCCCCCC(=O)Nc1ccc(Br)cc1N
InChIInChI=1S/C15H23BrN2O/c1-2-3-4-5-6-7-8-15(19)18-14-10-9-12(16)11-13(14)17/h9-11H,2-8,17H2,1H3,(H,18,19)
InChIKeyPWHYUFOGOZVDTC-UHFFFAOYSA-N
XLogP4.72
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.27
LogP ≤ 54.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(4-bromo-2-methylphenyl)octanamide
CID 4582485
N-(2,4-dibromophenyl)hexanamide
CID 4251482
N-(4-bromo-2-oxamoylphenyl)octanamide
CID 102529539
N-(2-amino-4-methoxyphenyl)nonanamide
CID 65449480
N-(2-aminophenyl)octadecanamide
CID 68839220
N-(5-bromo-2-methoxyphenyl)octanamide
CID 60540438
N-[5-bromo-2-(4-bromophenyl)phenyl]decanamide
CID 46193338
N-(4-amino-2-fluorophenyl)heptanamide
CID 28691330
N-(2-amino-4-bromophenyl)-2-chloroacetamide
CID 66911433
N-(2-amino-5-methylphenyl)heptanamide
CID 114752035
1-(2-amino-4-bromophenyl)undecan-1-one
CID 116591772
N-(2-amino-4-bromophenyl)-2-ethylhexanamide
CID 43130493

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-bromophenyl)nonanamide?
The IUPAC name of N-(2-amino-4-bromophenyl)nonanamide (CID 65449103) is N-(2-amino-4-bromophenyl)nonanamide.
What is the SMILES notation for N-(2-amino-4-bromophenyl)nonanamide?
The canonical SMILES for N-(2-amino-4-bromophenyl)nonanamide is CCCCCCCCC(=O)Nc1ccc(Br)cc1N.
What is the InChIKey of N-(2-amino-4-bromophenyl)nonanamide?
The InChIKey is PWHYUFOGOZVDTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23BrN2O/c1-2-3-4-5-6-7-8-15(19)18-14-10-9-12(16)11-13(14)17/h9-11H,2-8,17H2,1H3,(H,18,19).
What are the key properties of N-(2-amino-4-bromophenyl)nonanamide?
N-(2-amino-4-bromophenyl)nonanamide has a molecular weight of 327.27 g/mol, XLogP of 4.72, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-bromophenyl)nonanamide is sourced from PubChem (CID 65449103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).