5-[bis(2-hydroxyethyl)amino]-2-nitrosophenol

C10H14N2O4 — CID 89139773

IUPAC5-[bis(2-hydroxyethyl)amino]-2-nitrosophenol
SMILESO=Nc1ccc(N(CCO)CCO)cc1O
InChIInChI=1S/C10H14N2O4/c13-5-3-12(4-6-14)8-1-2-9(11-16)10(15)7-8/h1-2,7,13-15H,3-6H2
InChIKeyZYKXHWLZNVFFAJ-UHFFFAOYSA-N
MW226.23 g/mol
LogP0.58
Rot. Bonds6

About 5-[bis(2-hydroxyethyl)amino]-2-nitrosophenol

5-[bis(2-hydroxyethyl)amino]-2-nitrosophenol (PubChem CID 89139773) has the molecular formula C10H14N2O4 and a molecular weight of 226.23 g/mol. Its IUPAC name is 5-[bis(2-hydroxyethyl)amino]-2-nitrosophenol.

Molecular Properties

Compound Name5-[bis(2-hydroxyethyl)amino]-2-nitrosophenol
PubChem CID89139773
Molecular FormulaC10H14N2O4
Molecular Weight226.23 g/mol
Exact Mass226.10
IUPAC Name5-[bis(2-hydroxyethyl)amino]-2-nitrosophenol
SMILESO=Nc1ccc(N(CCO)CCO)cc1O
InChIInChI=1S/C10H14N2O4/c13-5-3-12(4-6-14)8-1-2-9(11-16)10(15)7-8/h1-2,7,13-15H,3-6H2
InChIKeyZYKXHWLZNVFFAJ-UHFFFAOYSA-N
XLogP0.58
TPSA93.36 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.23
LogP ≤ 50.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

3-(N-ethyl-3-hydroxy-4-nitrosoanilino)propane-1-sulfonic acid;hydrochloride
CID 88744843
[4-[bis(2-hydroxyethyl)amino]-2-(hydroxymethyl)phenyl]iminoazanium
CID 66600248
[4-(dipropylamino)-2-hydroxyphenyl]iminoazanium
CID 135608509
6-[bis(2-hydroxyethyl)amino]-2-chloro-3-nitrosophenol
CID 54269491
4-[[4-[bis(2-hydroxyethyl)amino]-2-fluorophenyl]diazenyl]benzenesulfonamide
CID 54210128
5-chloro-2-nitrosophenol
CID 119097385
1-(N-ethyl-3-hydroxy-4-nitrosoanilino)propane-1-sulfonic acid
CID 23002264
2-[4-[(2,5-difluorophenyl)diazenyl]-N-(2-hydroxyethyl)-3-methylanilino]ethanol
CID 4164065
2-[4-amino-N-(2-hydroxyethyl)anilino]ethanol
CID 67612353
5-[2-hydroxyethyl(propyl)amino]-2-[1-(propylamino)ethyl]phenol
CID 79603717
2-[4-amino-N-(2-hydroxyethyl)-3-methylsulfonylanilino]ethanol
CID 69344978
2-(1-hydroxyethyl)-5-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]phenol
CID 107481086

Frequently Asked Questions

What is the IUPAC name of 5-[bis(2-hydroxyethyl)amino]-2-nitrosophenol?
The IUPAC name of 5-[bis(2-hydroxyethyl)amino]-2-nitrosophenol (CID 89139773) is 5-[bis(2-hydroxyethyl)amino]-2-nitrosophenol.
What is the SMILES notation for 5-[bis(2-hydroxyethyl)amino]-2-nitrosophenol?
The canonical SMILES for 5-[bis(2-hydroxyethyl)amino]-2-nitrosophenol is O=Nc1ccc(N(CCO)CCO)cc1O.
What is the InChIKey of 5-[bis(2-hydroxyethyl)amino]-2-nitrosophenol?
The InChIKey is ZYKXHWLZNVFFAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O4/c13-5-3-12(4-6-14)8-1-2-9(11-16)10(15)7-8/h1-2,7,13-15H,3-6H2.
What are the key properties of 5-[bis(2-hydroxyethyl)amino]-2-nitrosophenol?
5-[bis(2-hydroxyethyl)amino]-2-nitrosophenol has a molecular weight of 226.23 g/mol, XLogP of 0.58, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[bis(2-hydroxyethyl)amino]-2-nitrosophenol is sourced from PubChem (CID 89139773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).