4-hydroxy-N-(2,4,6-tribromophenyl)pentanamide

C11H12Br3NO2 — CID 79201496

IUPAC4-hydroxy-N-(2,4,6-tribromophenyl)pentanamide
SMILESCC(O)CCC(=O)Nc1c(Br)cc(Br)cc1Br
InChIInChI=1S/C11H12Br3NO2/c1-6(16)2-3-10(17)15-11-8(13)4-7(12)5-9(11)14/h4-6,16H,2-3H2,1H3,(H,15,17)
InChIKeyNWUPYDOAHPFZEV-UHFFFAOYSA-N
MW429.93 g/mol
LogP4.07
Rot. Bonds4

About 4-hydroxy-N-(2,4,6-tribromophenyl)pentanamide

4-hydroxy-N-(2,4,6-tribromophenyl)pentanamide (PubChem CID 79201496) has the molecular formula C11H12Br3NO2 and a molecular weight of 429.93 g/mol. Its IUPAC name is 4-hydroxy-N-(2,4,6-tribromophenyl)pentanamide.

Molecular Properties

Compound Name4-hydroxy-N-(2,4,6-tribromophenyl)pentanamide
PubChem CID79201496
Molecular FormulaC11H12Br3NO2
Molecular Weight429.93 g/mol
Exact Mass426.84
IUPAC Name4-hydroxy-N-(2,4,6-tribromophenyl)pentanamide
SMILESCC(O)CCC(=O)Nc1c(Br)cc(Br)cc1Br
InChIInChI=1S/C11H12Br3NO2/c1-6(16)2-3-10(17)15-11-8(13)4-7(12)5-9(11)14/h4-6,16H,2-3H2,1H3,(H,15,17)
InChIKeyNWUPYDOAHPFZEV-UHFFFAOYSA-N
XLogP4.07
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.93
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(propan-2-ylamino)-N-(2,4,6-tribromophenyl)propanamide
CID 60854870
3-methyl-5-oxo-5-(2,4,6-tribromoanilino)pentanoic acid
CID 62965220
N-[2,4-dibromo-6-(2-methoxyethyl)phenyl]-4-methylpentanamide
CID 86806993
6-amino-4,4-dimethyl-N-(2,4,6-tribromophenyl)hexanamide
CID 65292805
N-(5-bromo-2-chlorophenyl)-4-hydroxypentanamide
CID 79192467
N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-4-hydroxypentanamide
CID 79200507
N,N'-bis(2,4,6-tribromophenyl)oxamide
CID 89438715
3-bromo-N-(2,6-dibromo-4-methylphenyl)propanamide
CID 115571577
N-(2-amino-4-bromo-6-methylphenyl)-4-methylpentanamide
CID 43549958
2-methyl-4-[(2,4,6-tribromophenyl)carbamoylamino]butanoic acid
CID 80540718
(2S)-2-amino-N-(2,4,6-tribromophenyl)pentanamide
CID 107568149
2-[[(1R,2S)-1-hydroxy-1-phenylpropan-2-yl]-methylamino]-N-(2,4,6-tribromophenyl)acetamide
CID 98083173

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(2,4,6-tribromophenyl)pentanamide?
The IUPAC name of 4-hydroxy-N-(2,4,6-tribromophenyl)pentanamide (CID 79201496) is 4-hydroxy-N-(2,4,6-tribromophenyl)pentanamide.
What is the SMILES notation for 4-hydroxy-N-(2,4,6-tribromophenyl)pentanamide?
The canonical SMILES for 4-hydroxy-N-(2,4,6-tribromophenyl)pentanamide is CC(O)CCC(=O)Nc1c(Br)cc(Br)cc1Br.
What is the InChIKey of 4-hydroxy-N-(2,4,6-tribromophenyl)pentanamide?
The InChIKey is NWUPYDOAHPFZEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12Br3NO2/c1-6(16)2-3-10(17)15-11-8(13)4-7(12)5-9(11)14/h4-6,16H,2-3H2,1H3,(H,15,17).
What are the key properties of 4-hydroxy-N-(2,4,6-tribromophenyl)pentanamide?
4-hydroxy-N-(2,4,6-tribromophenyl)pentanamide has a molecular weight of 429.93 g/mol, XLogP of 4.07, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(2,4,6-tribromophenyl)pentanamide is sourced from PubChem (CID 79201496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).