1-(2,2-dimethylhydrazinyl)-3-(2-methylphenoxy)propan-2-ol

C12H20N2O2 — CID 83014355

IUPAC1-(2,2-dimethylhydrazinyl)-3-(2-methylphenoxy)propan-2-ol
SMILESCc1ccccc1OCC(O)CNN(C)C
InChIInChI=1S/C12H20N2O2/c1-10-6-4-5-7-12(10)16-9-11(15)8-13-14(2)3/h4-7,11,13,15H,8-9H2,1-3H3
InChIKeyTYVSHRLTBWHGLD-UHFFFAOYSA-N
MW224.30 g/mol
LogP0.80
Rot. Bonds6

About 1-(2,2-dimethylhydrazinyl)-3-(2-methylphenoxy)propan-2-ol

1-(2,2-dimethylhydrazinyl)-3-(2-methylphenoxy)propan-2-ol (PubChem CID 83014355) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 1-(2,2-dimethylhydrazinyl)-3-(2-methylphenoxy)propan-2-ol.

Molecular Properties

Compound Name1-(2,2-dimethylhydrazinyl)-3-(2-methylphenoxy)propan-2-ol
PubChem CID83014355
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name1-(2,2-dimethylhydrazinyl)-3-(2-methylphenoxy)propan-2-ol
SMILESCc1ccccc1OCC(O)CNN(C)C
InChIInChI=1S/C12H20N2O2/c1-10-6-4-5-7-12(10)16-9-11(15)8-13-14(2)3/h4-7,11,13,15H,8-9H2,1-3H3
InChIKeyTYVSHRLTBWHGLD-UHFFFAOYSA-N
XLogP0.80
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2S)-1-[[(2S)-2-hydroxypropyl]amino]-3-(2-methylphenoxy)propan-2-ol
CID 7830763
(2R)-1-(tert-butylamino)-3-(2-methylphenoxy)propan-2-ol
CID 27319600
(2R)-1-[[(2R)-butan-2-yl]amino]-3-(2-methylphenoxy)propan-2-ol
CID 27319633
1-(4-methylpentan-2-ylamino)-3-(2-methylphenoxy)propan-2-ol
CID 60902172
2-[[2-hydroxy-3-(2-methylphenoxy)propyl]amino]-2-methylpropan-1-ol
CID 13104426
1-(3-methylbutylamino)-3-(2-methylphenoxy)propan-2-ol
CID 60633605
1-[4-(methylamino)butan-2-ylamino]-3-(2-methylphenoxy)propan-2-ol
CID 54332913
N-[2-hydroxy-3-(2-methylphenoxy)propyl]-2-methylbenzamide
CID 84562345
1-(2-methylphenoxy)-3-[(4-methylphenyl)methylamino]propan-2-ol
CID 60632285
1-(3-aminopropylamino)-3-(2-methylphenoxy)propan-2-ol
CID 62273853
1-[2-[2-methoxyethyl(methyl)amino]ethylamino]-3-(2-methylphenoxy)propan-2-ol
CID 62843457
1-(2-methylphenoxy)-3-(octylamino)propan-2-ol
CID 12548704

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylhydrazinyl)-3-(2-methylphenoxy)propan-2-ol?
The IUPAC name of 1-(2,2-dimethylhydrazinyl)-3-(2-methylphenoxy)propan-2-ol (CID 83014355) is 1-(2,2-dimethylhydrazinyl)-3-(2-methylphenoxy)propan-2-ol.
What is the SMILES notation for 1-(2,2-dimethylhydrazinyl)-3-(2-methylphenoxy)propan-2-ol?
The canonical SMILES for 1-(2,2-dimethylhydrazinyl)-3-(2-methylphenoxy)propan-2-ol is Cc1ccccc1OCC(O)CNN(C)C.
What is the InChIKey of 1-(2,2-dimethylhydrazinyl)-3-(2-methylphenoxy)propan-2-ol?
The InChIKey is TYVSHRLTBWHGLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-10-6-4-5-7-12(10)16-9-11(15)8-13-14(2)3/h4-7,11,13,15H,8-9H2,1-3H3.
What are the key properties of 1-(2,2-dimethylhydrazinyl)-3-(2-methylphenoxy)propan-2-ol?
1-(2,2-dimethylhydrazinyl)-3-(2-methylphenoxy)propan-2-ol has a molecular weight of 224.30 g/mol, XLogP of 0.80, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylhydrazinyl)-3-(2-methylphenoxy)propan-2-ol is sourced from PubChem (CID 83014355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).