1,1-di(propan-2-yl)hydrazine;propan-2-yl 4-hydroxy-2-methylbutanoate

C14H32N2O3 — CID 145423953

IUPAC1,1-di(propan-2-yl)hydrazine;propan-2-yl 4-hydroxy-2-methylbutanoate
SMILESCC(C)N(N)C(C)C.CC(C)OC(=O)C(C)CCO
InChIInChI=1S/C8H16O3.C6H16N2/c1-6(2)11-8(10)7(3)4-5-9;1-5(2)8(7)6(3)4/h6-7,9H,4-5H2,1-3H3;5-6H,7H2,1-4H3
InChIKeyZEOYYJKMQAECRI-UHFFFAOYSA-N
MW276.42 g/mol
LogP1.94
Rot. Bonds6

About 1,1-di(propan-2-yl)hydrazine;propan-2-yl 4-hydroxy-2-methylbutanoate

1,1-di(propan-2-yl)hydrazine;propan-2-yl 4-hydroxy-2-methylbutanoate (PubChem CID 145423953) has the molecular formula C14H32N2O3 and a molecular weight of 276.42 g/mol. Its IUPAC name is 1,1-di(propan-2-yl)hydrazine;propan-2-yl 4-hydroxy-2-methylbutanoate.

Molecular Properties

Compound Name1,1-di(propan-2-yl)hydrazine;propan-2-yl 4-hydroxy-2-methylbutanoate
PubChem CID145423953
Molecular FormulaC14H32N2O3
Molecular Weight276.42 g/mol
Exact Mass276.24
IUPAC Name1,1-di(propan-2-yl)hydrazine;propan-2-yl 4-hydroxy-2-methylbutanoate
SMILESCC(C)N(N)C(C)C.CC(C)OC(=O)C(C)CCO
InChIInChI=1S/C8H16O3.C6H16N2/c1-6(2)11-8(10)7(3)4-5-9;1-5(2)8(7)6(3)4/h6-7,9H,4-5H2,1-3H3;5-6H,7H2,1-4H3
InChIKeyZEOYYJKMQAECRI-UHFFFAOYSA-N
XLogP1.94
TPSA75.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1-di(propan-2-yl)hydrazine;propan-2-yl 4-hydroxy-2-methylbutanoate?
The IUPAC name of 1,1-di(propan-2-yl)hydrazine;propan-2-yl 4-hydroxy-2-methylbutanoate (CID 145423953) is 1,1-di(propan-2-yl)hydrazine;propan-2-yl 4-hydroxy-2-methylbutanoate.
What is the SMILES notation for 1,1-di(propan-2-yl)hydrazine;propan-2-yl 4-hydroxy-2-methylbutanoate?
The canonical SMILES for 1,1-di(propan-2-yl)hydrazine;propan-2-yl 4-hydroxy-2-methylbutanoate is CC(C)N(N)C(C)C.CC(C)OC(=O)C(C)CCO.
What is the InChIKey of 1,1-di(propan-2-yl)hydrazine;propan-2-yl 4-hydroxy-2-methylbutanoate?
The InChIKey is ZEOYYJKMQAECRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O3.C6H16N2/c1-6(2)11-8(10)7(3)4-5-9;1-5(2)8(7)6(3)4/h6-7,9H,4-5H2,1-3H3;5-6H,7H2,1-4H3.
What are the key properties of 1,1-di(propan-2-yl)hydrazine;propan-2-yl 4-hydroxy-2-methylbutanoate?
1,1-di(propan-2-yl)hydrazine;propan-2-yl 4-hydroxy-2-methylbutanoate has a molecular weight of 276.42 g/mol, XLogP of 1.94, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-di(propan-2-yl)hydrazine;propan-2-yl 4-hydroxy-2-methylbutanoate is sourced from PubChem (CID 145423953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).