5-[1-(2,2-dimethylhydrazinyl)ethyl]benzene-1,3-diol

C10H16N2O2 — CID 107707064

IUPAC5-[1-(2,2-dimethylhydrazinyl)ethyl]benzene-1,3-diol
SMILESCC(NN(C)C)c1cc(O)cc(O)c1
InChIInChI=1S/C10H16N2O2/c1-7(11-12(2)3)8-4-9(13)6-10(14)5-8/h4-7,11,13-14H,1-3H3
InChIKeyFUUPCRBHXSBMFW-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.23
Rot. Bonds3

About 5-[1-(2,2-dimethylhydrazinyl)ethyl]benzene-1,3-diol

5-[1-(2,2-dimethylhydrazinyl)ethyl]benzene-1,3-diol (PubChem CID 107707064) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 5-[1-(2,2-dimethylhydrazinyl)ethyl]benzene-1,3-diol.

Molecular Properties

Compound Name5-[1-(2,2-dimethylhydrazinyl)ethyl]benzene-1,3-diol
PubChem CID107707064
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name5-[1-(2,2-dimethylhydrazinyl)ethyl]benzene-1,3-diol
SMILESCC(NN(C)C)c1cc(O)cc(O)c1
InChIInChI=1S/C10H16N2O2/c1-7(11-12(2)3)8-4-9(13)6-10(14)5-8/h4-7,11,13-14H,1-3H3
InChIKeyFUUPCRBHXSBMFW-UHFFFAOYSA-N
XLogP1.23
TPSA55.73 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-[1-[2-[methyl(propan-2-yl)amino]ethylamino]ethyl]benzene-1,3-diol
CID 107706480
2-[1-(3,4-dimethylphenyl)ethyl]-1,1-dimethylhydrazine
CID 83004020
5-[1-[3-[methyl(propan-2-yl)amino]propylamino]ethyl]benzene-1,3-diol
CID 106040787
2-[1-(4-fluorophenyl)ethyl]-1,1-dimethylhydrazine
CID 83003219
5-[1-[[2-(dimethylamino)-4-methylpentyl]amino]ethyl]benzene-1,3-diol
CID 107705372
5-[1-[methyl-[2-(methylamino)ethyl]amino]ethyl]benzene-1,3-diol
CID 107707637
5-[1-(but-3-en-2-ylamino)ethyl]benzene-1,3-diol
CID 107707220
2-[1-(3,5-dihydroxyphenyl)ethylamino]propanamide
CID 107705454
5-[1-[[(1S)-1-pyridin-4-ylethyl]amino]ethyl]benzene-1,3-diol
CID 107706948
2-[1-(3,5-dihydroxyphenyl)ethylamino]ethanesulfonamide
CID 107705457
5-[1-[5-bromo-2-(dimethylamino)anilino]ethyl]benzene-1,3-diol
CID 107705933
5-[1-(2-methylsulfanylethylamino)ethyl]benzene-1,3-diol
CID 107706581

Frequently Asked Questions

What is the IUPAC name of 5-[1-(2,2-dimethylhydrazinyl)ethyl]benzene-1,3-diol?
The IUPAC name of 5-[1-(2,2-dimethylhydrazinyl)ethyl]benzene-1,3-diol (CID 107707064) is 5-[1-(2,2-dimethylhydrazinyl)ethyl]benzene-1,3-diol.
What is the SMILES notation for 5-[1-(2,2-dimethylhydrazinyl)ethyl]benzene-1,3-diol?
The canonical SMILES for 5-[1-(2,2-dimethylhydrazinyl)ethyl]benzene-1,3-diol is CC(NN(C)C)c1cc(O)cc(O)c1.
What is the InChIKey of 5-[1-(2,2-dimethylhydrazinyl)ethyl]benzene-1,3-diol?
The InChIKey is FUUPCRBHXSBMFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-7(11-12(2)3)8-4-9(13)6-10(14)5-8/h4-7,11,13-14H,1-3H3.
What are the key properties of 5-[1-(2,2-dimethylhydrazinyl)ethyl]benzene-1,3-diol?
5-[1-(2,2-dimethylhydrazinyl)ethyl]benzene-1,3-diol has a molecular weight of 196.25 g/mol, XLogP of 1.23, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(2,2-dimethylhydrazinyl)ethyl]benzene-1,3-diol is sourced from PubChem (CID 107707064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).