N-[2-[2-(dimethylamino)ethyl]phenyl]hydroxylamine

C10H16N2O — CID 57171134

IUPACN-[2-[2-(dimethylamino)ethyl]phenyl]hydroxylamine
SMILESCN(C)CCc1ccccc1NO
InChIInChI=1S/C10H16N2O/c1-12(2)8-7-9-5-3-4-6-10(9)11-13/h3-6,11,13H,7-8H2,1-2H3
InChIKeyOKEIXXBPDLPUHG-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.59
Rot. Bonds4

About N-[2-[2-(dimethylamino)ethyl]phenyl]hydroxylamine

N-[2-[2-(dimethylamino)ethyl]phenyl]hydroxylamine (PubChem CID 57171134) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is N-[2-[2-(dimethylamino)ethyl]phenyl]hydroxylamine.

Molecular Properties

Compound NameN-[2-[2-(dimethylamino)ethyl]phenyl]hydroxylamine
PubChem CID57171134
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC NameN-[2-[2-(dimethylamino)ethyl]phenyl]hydroxylamine
SMILESCN(C)CCc1ccccc1NO
InChIInChI=1S/C10H16N2O/c1-12(2)8-7-9-5-3-4-6-10(9)11-13/h3-6,11,13H,7-8H2,1-2H3
InChIKeyOKEIXXBPDLPUHG-UHFFFAOYSA-N
XLogP1.59
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[2-[2-[butyl(methyl)amino]ethyl-methylamino]ethyl]phenyl]hydroxylamine
CID 90685954
2,6-dichloro-N-[2-[2-(dimethylamino)ethyl]phenyl]aniline
CID 68796254
4-[2-[2-(dimethylamino)ethyl]anilino]benzoic acid
CID 18783963
N-[2-[2-(dimethylamino)ethyl]phenyl]-2-hydroxy-2,2-diphenylacetamide
CID 167755447
4-[[2-[2-(dimethylamino)ethyl]anilino]methyl]benzoic acid
CID 122033254
N-(2-benzylphenyl)hydroxylamine
CID 3014197
N-[4-[2-[2-(dimethylamino)ethyl]phenyl]-1-phenylbutylidene]hydroxylamine
CID 88690466
2-[2-(dimethylamino)ethyl]benzenesulfinate
CID 70894494
2-[2-(dimethylamino)ethyl]benzenesulfonamide
CID 69371931
1-[2-(dimethylamino)ethyl]-3-(2-ethylphenyl)urea
CID 23764430
bromo-[2-[2-(dimethylamino)ethyl]phenyl]-diphenylphosphanium
CID 163376033
2-[[4-(2-bromoanilino)-1-oxo-1,2,5-thiadiazol-3-yl]amino]-6-[2-(dimethylamino)ethyl]phenol
CID 143077219

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(dimethylamino)ethyl]phenyl]hydroxylamine?
The IUPAC name of N-[2-[2-(dimethylamino)ethyl]phenyl]hydroxylamine (CID 57171134) is N-[2-[2-(dimethylamino)ethyl]phenyl]hydroxylamine.
What is the SMILES notation for N-[2-[2-(dimethylamino)ethyl]phenyl]hydroxylamine?
The canonical SMILES for N-[2-[2-(dimethylamino)ethyl]phenyl]hydroxylamine is CN(C)CCc1ccccc1NO.
What is the InChIKey of N-[2-[2-(dimethylamino)ethyl]phenyl]hydroxylamine?
The InChIKey is OKEIXXBPDLPUHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-12(2)8-7-9-5-3-4-6-10(9)11-13/h3-6,11,13H,7-8H2,1-2H3.
What are the key properties of N-[2-[2-(dimethylamino)ethyl]phenyl]hydroxylamine?
N-[2-[2-(dimethylamino)ethyl]phenyl]hydroxylamine has a molecular weight of 180.25 g/mol, XLogP of 1.59, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(dimethylamino)ethyl]phenyl]hydroxylamine is sourced from PubChem (CID 57171134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).