(2Z)-2-(ethylhydrazinylidene)-3-methylbutan-1-ol

C7H16N2O — CID 20702679

IUPAC(2Z)-2-(ethylhydrazinylidene)-3-methylbutan-1-ol
SMILESCCN/N=C(\CO)C(C)C
InChIInChI=1S/C7H16N2O/c1-4-8-9-7(5-10)6(2)3/h6,8,10H,4-5H2,1-3H3/b9-7+
InChIKeyGPYADWHUNYVVQR-VQHVLOKHSA-N
MW144.22 g/mol
LogP0.60
Rot. Bonds4

About (2Z)-2-(ethylhydrazinylidene)-3-methylbutan-1-ol

(2Z)-2-(ethylhydrazinylidene)-3-methylbutan-1-ol (PubChem CID 20702679) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is (2Z)-2-(ethylhydrazinylidene)-3-methylbutan-1-ol.

Molecular Properties

Compound Name(2Z)-2-(ethylhydrazinylidene)-3-methylbutan-1-ol
PubChem CID20702679
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Name(2Z)-2-(ethylhydrazinylidene)-3-methylbutan-1-ol
SMILESCCN/N=C(\CO)C(C)C
InChIInChI=1S/C7H16N2O/c1-4-8-9-7(5-10)6(2)3/h6,8,10H,4-5H2,1-3H3/b9-7+
InChIKeyGPYADWHUNYVVQR-VQHVLOKHSA-N
XLogP0.60
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', '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 (2Z)-2-(ethylhydrazinylidene)-3-methylbutan-1-ol?
The IUPAC name of (2Z)-2-(ethylhydrazinylidene)-3-methylbutan-1-ol (CID 20702679) is (2Z)-2-(ethylhydrazinylidene)-3-methylbutan-1-ol.
What is the SMILES notation for (2Z)-2-(ethylhydrazinylidene)-3-methylbutan-1-ol?
The canonical SMILES for (2Z)-2-(ethylhydrazinylidene)-3-methylbutan-1-ol is CCN/N=C(\CO)C(C)C.
What is the InChIKey of (2Z)-2-(ethylhydrazinylidene)-3-methylbutan-1-ol?
The InChIKey is GPYADWHUNYVVQR-VQHVLOKHSA-N. The full InChI is InChI=1S/C7H16N2O/c1-4-8-9-7(5-10)6(2)3/h6,8,10H,4-5H2,1-3H3/b9-7+.
What are the key properties of (2Z)-2-(ethylhydrazinylidene)-3-methylbutan-1-ol?
(2Z)-2-(ethylhydrazinylidene)-3-methylbutan-1-ol has a molecular weight of 144.22 g/mol, XLogP of 0.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-(ethylhydrazinylidene)-3-methylbutan-1-ol is sourced from PubChem (CID 20702679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).