(3-methyl-1-phenoxypentan-2-yl)hydrazine

C12H20N2O — CID 105213082

IUPAC(3-methyl-1-phenoxypentan-2-yl)hydrazine
SMILESCCC(C)C(COc1ccccc1)NN
InChIInChI=1S/C12H20N2O/c1-3-10(2)12(14-13)9-15-11-7-5-4-6-8-11/h4-8,10,12,14H,3,9,13H2,1-2H3
InChIKeyVHVSISNCWDBUFL-UHFFFAOYSA-N
MW208.31 g/mol
LogP1.94
Rot. Bonds6

About (3-methyl-1-phenoxypentan-2-yl)hydrazine

(3-methyl-1-phenoxypentan-2-yl)hydrazine (PubChem CID 105213082) has the molecular formula C12H20N2O and a molecular weight of 208.31 g/mol. Its IUPAC name is (3-methyl-1-phenoxypentan-2-yl)hydrazine.

Molecular Properties

Compound Name(3-methyl-1-phenoxypentan-2-yl)hydrazine
PubChem CID105213082
Molecular FormulaC12H20N2O
Molecular Weight208.31 g/mol
Exact Mass208.16
IUPAC Name(3-methyl-1-phenoxypentan-2-yl)hydrazine
SMILESCCC(C)C(COc1ccccc1)NN
InChIInChI=1S/C12H20N2O/c1-3-10(2)12(14-13)9-15-11-7-5-4-6-8-11/h4-8,10,12,14H,3,9,13H2,1-2H3
InChIKeyVHVSISNCWDBUFL-UHFFFAOYSA-N
XLogP1.94
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 51.94
H-Bond Donors ≤ 52
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

(4-methyl-1-phenoxyhexan-3-yl)hydrazine
CID 105191489
N,3-dimethyl-1-phenoxyhexan-2-amine
CID 107893778
(4-methyl-1-phenoxypentan-2-yl)hydrazine
CID 105212878
(5-methyl-1-phenoxyhexan-2-yl)hydrazine
CID 105212879
1-phenoxy-N-propan-2-ylbutan-2-amine
CID 115905778
(1-methoxy-3-methylpentan-2-yl)hydrazine
CID 105207314
1-phenoxydecan-2-ylhydrazine
CID 105212962
[1-(3,4-dihydro-1H-isochromen-1-yl)-3-methylpentan-2-yl]hydrazine
CID 114984660
CID 142401703
CID 142401703
ethane;1-phenoxypropan-2-ol;propane
CID 90979198
amino(1-phenoxypropan-2-yl)azanium
CID 20838095
[1-(2-bromophenyl)-3-methylpentan-2-yl]hydrazine
CID 105214988

Frequently Asked Questions

What is the IUPAC name of (3-methyl-1-phenoxypentan-2-yl)hydrazine?
The IUPAC name of (3-methyl-1-phenoxypentan-2-yl)hydrazine (CID 105213082) is (3-methyl-1-phenoxypentan-2-yl)hydrazine.
What is the SMILES notation for (3-methyl-1-phenoxypentan-2-yl)hydrazine?
The canonical SMILES for (3-methyl-1-phenoxypentan-2-yl)hydrazine is CCC(C)C(COc1ccccc1)NN.
What is the InChIKey of (3-methyl-1-phenoxypentan-2-yl)hydrazine?
The InChIKey is VHVSISNCWDBUFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-3-10(2)12(14-13)9-15-11-7-5-4-6-8-11/h4-8,10,12,14H,3,9,13H2,1-2H3.
What are the key properties of (3-methyl-1-phenoxypentan-2-yl)hydrazine?
(3-methyl-1-phenoxypentan-2-yl)hydrazine has a molecular weight of 208.31 g/mol, XLogP of 1.94, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methyl-1-phenoxypentan-2-yl)hydrazine is sourced from PubChem (CID 105213082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).