1-(2,2-dimethyloxan-4-yl)-1-phenylhydrazine

C13H20N2O — CID 13449722

IUPAC1-(2,2-dimethyloxan-4-yl)-1-phenylhydrazine
SMILESCC1(C)CC(N(N)c2ccccc2)CCO1
InChIInChI=1S/C13H20N2O/c1-13(2)10-12(8-9-16-13)15(14)11-6-4-3-5-7-11/h3-7,12H,8-10,14H2,1-2H3
InChIKeyALYKKHZIRLGIRF-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.32
Rot. Bonds2

About 1-(2,2-dimethyloxan-4-yl)-1-phenylhydrazine

1-(2,2-dimethyloxan-4-yl)-1-phenylhydrazine (PubChem CID 13449722) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 1-(2,2-dimethyloxan-4-yl)-1-phenylhydrazine.

Molecular Properties

Compound Name1-(2,2-dimethyloxan-4-yl)-1-phenylhydrazine
PubChem CID13449722
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name1-(2,2-dimethyloxan-4-yl)-1-phenylhydrazine
SMILESCC1(C)CC(N(N)c2ccccc2)CCO1
InChIInChI=1S/C13H20N2O/c1-13(2)10-12(8-9-16-13)15(14)11-6-4-3-5-7-11/h3-7,12H,8-10,14H2,1-2H3
InChIKeyALYKKHZIRLGIRF-UHFFFAOYSA-N
XLogP2.32
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-benzyl-2,2-dimethyl-N-(2-phenylethyl)oxan-4-amine chloride
CID 53351142
N-[(3R)-3-cyclopropyl-3-phenylbutyl]-N-[(4R)-2,2-dimethyloxan-4-yl]acetamide
CID 39309555
2-[(2,2-dimethyloxan-4-yl)-methylamino]acetic acid
CID 65056592
N-[(4S)-2,2-dimethyloxan-4-yl]-N-[(1R)-1-phenylethyl]morpholine-4-carboxamide
CID 7711465
N-[2-(1-benzylcyclopentyl)ethyl]-N-(2,2-dimethyloxan-4-yl)acetamide
CID 42654291
N-[(4S)-2,2-dimethyloxan-4-yl]-N-[(1S)-1-phenylethyl]morpholine-4-carboxamide
CID 7711463
4-N-(2,2-dimethyloxan-4-yl)-4-N-methylcyclohexane-1,4-diamine
CID 79113521
1-(2-methylcyclohexyl)-1-phenylhydrazine
CID 19593890
1-benzyl-4-(2,2-dimethyloxan-4-yl)piperidine
CID 159650765
[(3R)-3-[(4R)-2,2-dimethyloxan-4-yl]-3-phenylpropyl]azanium
CID 6937612
(4S)-2,2-dimethyl-N-[(1S)-1-phenylethyl]oxan-4-amine
CID 756075
(4R)-2,2-dimethyl-4-[2-(trifluoromethyl)phenyl]oxane
CID 67814317

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethyloxan-4-yl)-1-phenylhydrazine?
The IUPAC name of 1-(2,2-dimethyloxan-4-yl)-1-phenylhydrazine (CID 13449722) is 1-(2,2-dimethyloxan-4-yl)-1-phenylhydrazine.
What is the SMILES notation for 1-(2,2-dimethyloxan-4-yl)-1-phenylhydrazine?
The canonical SMILES for 1-(2,2-dimethyloxan-4-yl)-1-phenylhydrazine is CC1(C)CC(N(N)c2ccccc2)CCO1.
What is the InChIKey of 1-(2,2-dimethyloxan-4-yl)-1-phenylhydrazine?
The InChIKey is ALYKKHZIRLGIRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-13(2)10-12(8-9-16-13)15(14)11-6-4-3-5-7-11/h3-7,12H,8-10,14H2,1-2H3.
What are the key properties of 1-(2,2-dimethyloxan-4-yl)-1-phenylhydrazine?
1-(2,2-dimethyloxan-4-yl)-1-phenylhydrazine has a molecular weight of 220.32 g/mol, XLogP of 2.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethyloxan-4-yl)-1-phenylhydrazine is sourced from PubChem (CID 13449722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).