N-[(2-bromophenyl)methyl]-2-hydroxy-N-methylacetamide

C10H12BrNO2 — CID 16769580

IUPACN-[(2-bromophenyl)methyl]-2-hydroxy-N-methylacetamide
SMILESCN(Cc1ccccc1Br)C(=O)CO
InChIInChI=1S/C10H12BrNO2/c1-12(10(14)7-13)6-8-4-2-3-5-9(8)11/h2-5,13H,6-7H2,1H3
InChIKeyZLDUFBMRADMDLF-UHFFFAOYSA-N
MW258.11 g/mol
LogP1.40
Rot. Bonds3

About N-[(2-bromophenyl)methyl]-2-hydroxy-N-methylacetamide

N-[(2-bromophenyl)methyl]-2-hydroxy-N-methylacetamide (PubChem CID 16769580) has the molecular formula C10H12BrNO2 and a molecular weight of 258.11 g/mol. Its IUPAC name is N-[(2-bromophenyl)methyl]-2-hydroxy-N-methylacetamide.

Molecular Properties

Compound NameN-[(2-bromophenyl)methyl]-2-hydroxy-N-methylacetamide
PubChem CID16769580
Molecular FormulaC10H12BrNO2
Molecular Weight258.11 g/mol
Exact Mass257.01
IUPAC NameN-[(2-bromophenyl)methyl]-2-hydroxy-N-methylacetamide
SMILESCN(Cc1ccccc1Br)C(=O)CO
InChIInChI=1S/C10H12BrNO2/c1-12(10(14)7-13)6-8-4-2-3-5-9(8)11/h2-5,13H,6-7H2,1H3
InChIKeyZLDUFBMRADMDLF-UHFFFAOYSA-N
XLogP1.40
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.11
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-bromophenyl)methyl]-4-hydroxy-N-methylbutanamide
CID 79204909
3-(2-bromophenyl)-N-[(2-bromophenyl)methyl]-N-methylpropanamide
CID 55833713
N-[(2-bromophenyl)methyl]-N,3-dimethylbutanamide
CID 60630959
N-[(2-bromophenyl)methyl]-N-methylheptanamide
CID 113221232
2-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]acetamide
CID 16769161
1-[(2-bromophenyl)methyl]-1-methylurea
CID 60703114
N-[(2-bromophenyl)methyl]-4-ethoxy-N-methylbutanamide
CID 112728025
N-[(2-bromophenyl)methyl]-N-methyl-4-(methylamino)butanamide
CID 54869193
N-[(2-bromophenyl)methyl]-2-(2,3-dihydroxypropylsulfanyl)-N-methylacetamide
CID 79683187
N-[(2-bromophenyl)methyl]-2-(ethylamino)-N-methylacetamide
CID 60641092
3-[bis(dimethylamino)methylideneamino]-N-[(2-bromophenyl)methyl]-N-methylpropanamide;hydroiodide
CID 111808087
N-[(2-bromophenyl)methyl]-N,2,2-trimethylbutanamide
CID 55102721

Frequently Asked Questions

What is the IUPAC name of N-[(2-bromophenyl)methyl]-2-hydroxy-N-methylacetamide?
The IUPAC name of N-[(2-bromophenyl)methyl]-2-hydroxy-N-methylacetamide (CID 16769580) is N-[(2-bromophenyl)methyl]-2-hydroxy-N-methylacetamide.
What is the SMILES notation for N-[(2-bromophenyl)methyl]-2-hydroxy-N-methylacetamide?
The canonical SMILES for N-[(2-bromophenyl)methyl]-2-hydroxy-N-methylacetamide is CN(Cc1ccccc1Br)C(=O)CO.
What is the InChIKey of N-[(2-bromophenyl)methyl]-2-hydroxy-N-methylacetamide?
The InChIKey is ZLDUFBMRADMDLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrNO2/c1-12(10(14)7-13)6-8-4-2-3-5-9(8)11/h2-5,13H,6-7H2,1H3.
What are the key properties of N-[(2-bromophenyl)methyl]-2-hydroxy-N-methylacetamide?
N-[(2-bromophenyl)methyl]-2-hydroxy-N-methylacetamide has a molecular weight of 258.11 g/mol, XLogP of 1.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-bromophenyl)methyl]-2-hydroxy-N-methylacetamide is sourced from PubChem (CID 16769580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).