N-(2-bromophenyl)-N-methylhydroxylamine

C7H8BrNO — CID 58554811

IUPACN-(2-bromophenyl)-N-methylhydroxylamine
SMILESCN(O)c1ccccc1Br
InChIInChI=1S/C7H8BrNO/c1-9(10)7-5-3-2-4-6(7)8/h2-5,10H,1H3
InChIKeyCRIGTPVZXLRVLH-UHFFFAOYSA-N
MW202.05 g/mol
LogP2.27
Rot. Bonds1

About N-(2-bromophenyl)-N-methylhydroxylamine

N-(2-bromophenyl)-N-methylhydroxylamine (PubChem CID 58554811) has the molecular formula C7H8BrNO and a molecular weight of 202.05 g/mol. Its IUPAC name is N-(2-bromophenyl)-N-methylhydroxylamine.

Molecular Properties

Compound NameN-(2-bromophenyl)-N-methylhydroxylamine
PubChem CID58554811
Molecular FormulaC7H8BrNO
Molecular Weight202.05 g/mol
Exact Mass200.98
IUPAC NameN-(2-bromophenyl)-N-methylhydroxylamine
SMILESCN(O)c1ccccc1Br
InChIInChI=1S/C7H8BrNO/c1-9(10)7-5-3-2-4-6(7)8/h2-5,10H,1H3
InChIKeyCRIGTPVZXLRVLH-UHFFFAOYSA-N
XLogP2.27
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.05
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(2-chlorophenyl)-N-methylhydroxylamine
CID 87898260
2-bromo-N-methyl-N-propan-2-ylaniline
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1-(2-bromo-N-methylanilino)propan-2-ol
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2-bromo-N-methyl-N-(2-methylpropyl)aniline
CID 11149184
N'-(2-bromophenyl)-N,N'-dimethylmethanediamine
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N-[(2-bromophenyl)methyl]-N-methylhydroxylamine
CID 82613877
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CID 175061094
2-(2-bromo-N-methylanilino)-2-methylpropanenitrile
CID 115129229
2-N-(2-bromophenyl)-2-N-methylpropane-1,2-diamine
CID 82021054
3-(2-bromo-N-methylanilino)-2,2-dimethyl-3-oxopropanoic acid
CID 115164003
methyl 2-(2-bromo-N-methylanilino)acetate
CID 115232844
2-bromo-N-ethyl-N-oxidoaniline
CID 163570782

Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-N-methylhydroxylamine?
The IUPAC name of N-(2-bromophenyl)-N-methylhydroxylamine (CID 58554811) is N-(2-bromophenyl)-N-methylhydroxylamine.
What is the SMILES notation for N-(2-bromophenyl)-N-methylhydroxylamine?
The canonical SMILES for N-(2-bromophenyl)-N-methylhydroxylamine is CN(O)c1ccccc1Br.
What is the InChIKey of N-(2-bromophenyl)-N-methylhydroxylamine?
The InChIKey is CRIGTPVZXLRVLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8BrNO/c1-9(10)7-5-3-2-4-6(7)8/h2-5,10H,1H3.
What are the key properties of N-(2-bromophenyl)-N-methylhydroxylamine?
N-(2-bromophenyl)-N-methylhydroxylamine has a molecular weight of 202.05 g/mol, XLogP of 2.27, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)-N-methylhydroxylamine is sourced from PubChem (CID 58554811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).