4-bromo-2-hydroxy-N-(3-methyl-2-propan-2-ylbutyl)benzamide

C15H22BrNO2 — CID 102906485

IUPAC4-bromo-2-hydroxy-N-(3-methyl-2-propan-2-ylbutyl)benzamide
SMILESCC(C)C(CNC(=O)c1ccc(Br)cc1O)C(C)C
InChIInChI=1S/C15H22BrNO2/c1-9(2)13(10(3)4)8-17-15(19)12-6-5-11(16)7-14(12)18/h5-7,9-10,13,18H,8H2,1-4H3,(H,17,19)
InChIKeyIYWJXKRYMZFOKV-UHFFFAOYSA-N
MW328.25 g/mol
LogP3.81
Rot. Bonds5

About 4-bromo-2-hydroxy-N-(3-methyl-2-propan-2-ylbutyl)benzamide

4-bromo-2-hydroxy-N-(3-methyl-2-propan-2-ylbutyl)benzamide (PubChem CID 102906485) has the molecular formula C15H22BrNO2 and a molecular weight of 328.25 g/mol. Its IUPAC name is 4-bromo-2-hydroxy-N-(3-methyl-2-propan-2-ylbutyl)benzamide.

Molecular Properties

Compound Name4-bromo-2-hydroxy-N-(3-methyl-2-propan-2-ylbutyl)benzamide
PubChem CID102906485
Molecular FormulaC15H22BrNO2
Molecular Weight328.25 g/mol
Exact Mass327.08
IUPAC Name4-bromo-2-hydroxy-N-(3-methyl-2-propan-2-ylbutyl)benzamide
SMILESCC(C)C(CNC(=O)c1ccc(Br)cc1O)C(C)C
InChIInChI=1S/C15H22BrNO2/c1-9(2)13(10(3)4)8-17-15(19)12-6-5-11(16)7-14(12)18/h5-7,9-10,13,18H,8H2,1-4H3,(H,17,19)
InChIKeyIYWJXKRYMZFOKV-UHFFFAOYSA-N
XLogP3.81
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.25
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-bromo-2-hydroxy-N-(3-methyl-2-propan-2-ylbutyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-bromo-2-chloro-N-(3-methyl-2-propan-2-ylbutyl)benzamide
CID 102914681
4-bromo-2-methoxy-N-(3-methyl-2-propan-2-ylbutyl)benzamide
CID 102906384
(2S)-3-[(4-bromo-2-hydroxybenzoyl)amino]-2-hydroxypropanoic acid
CID 107833831
4-bromo-2-hydroxy-N-(2-propan-2-yloxyethyl)benzamide
CID 113429309
4-bromo-2-hydroxy-N-(4-methylpentyl)benzamide
CID 63528181
2-[[(4-bromo-2-hydroxybenzoyl)amino]methyl]pentanoic acid
CID 65219579
4-bromo-2-hydroxy-N-[2-(methylamino)-2-oxoethyl]benzamide
CID 47435886
4-bromo-N-butan-2-yl-2-hydroxybenzamide
CID 47435868
4-bromo-2-hydroxy-N-(2-hydroxy-2-methylpropyl)benzamide
CID 65110103
4-hydroxy-2-methyl-N-(3-methyl-2-propan-2-ylbutyl)benzamide
CID 107091867
4-bromo-N-(5-chloro-4-methylpentyl)-2-hydroxybenzamide
CID 106156782
4-bromo-2-hydroxy-N-[(2-hydroxyphenyl)methyl]benzamide
CID 115598731

Frequently Asked Questions

What is the IUPAC name of 4-bromo-2-hydroxy-N-(3-methyl-2-propan-2-ylbutyl)benzamide?
The IUPAC name of 4-bromo-2-hydroxy-N-(3-methyl-2-propan-2-ylbutyl)benzamide (CID 102906485) is 4-bromo-2-hydroxy-N-(3-methyl-2-propan-2-ylbutyl)benzamide.
What is the SMILES notation for 4-bromo-2-hydroxy-N-(3-methyl-2-propan-2-ylbutyl)benzamide?
The canonical SMILES for 4-bromo-2-hydroxy-N-(3-methyl-2-propan-2-ylbutyl)benzamide is CC(C)C(CNC(=O)c1ccc(Br)cc1O)C(C)C.
What is the InChIKey of 4-bromo-2-hydroxy-N-(3-methyl-2-propan-2-ylbutyl)benzamide?
The InChIKey is IYWJXKRYMZFOKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22BrNO2/c1-9(2)13(10(3)4)8-17-15(19)12-6-5-11(16)7-14(12)18/h5-7,9-10,13,18H,8H2,1-4H3,(H,17,19).
What are the key properties of 4-bromo-2-hydroxy-N-(3-methyl-2-propan-2-ylbutyl)benzamide?
4-bromo-2-hydroxy-N-(3-methyl-2-propan-2-ylbutyl)benzamide has a molecular weight of 328.25 g/mol, XLogP of 3.81, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-2-hydroxy-N-(3-methyl-2-propan-2-ylbutyl)benzamide is sourced from PubChem (CID 102906485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).