1-[(2Z)-2-butan-2-ylidenehydrazinyl]ethanol

C6H14N2O — CID 129044868

IUPAC1-[(2Z)-2-butan-2-ylidenehydrazinyl]ethanol
SMILESCC/C(C)=N\NC(C)O
InChIInChI=1S/C6H14N2O/c1-4-5(2)7-8-6(3)9/h6,8-9H,4H2,1-3H3/b7-5-
InChIKeyGZNIKZZNXXWXTC-ALCCZGGFSA-N
MW130.19 g/mol
LogP0.70
Rot. Bonds3

About 1-[(2Z)-2-butan-2-ylidenehydrazinyl]ethanol

1-[(2Z)-2-butan-2-ylidenehydrazinyl]ethanol (PubChem CID 129044868) has the molecular formula C6H14N2O and a molecular weight of 130.19 g/mol. Its IUPAC name is 1-[(2Z)-2-butan-2-ylidenehydrazinyl]ethanol.

Molecular Properties

Compound Name1-[(2Z)-2-butan-2-ylidenehydrazinyl]ethanol
PubChem CID129044868
Molecular FormulaC6H14N2O
Molecular Weight130.19 g/mol
Exact Mass130.11
IUPAC Name1-[(2Z)-2-butan-2-ylidenehydrazinyl]ethanol
SMILESCC/C(C)=N\NC(C)O
InChIInChI=1S/C6H14N2O/c1-4-5(2)7-8-6(3)9/h6,8-9H,4H2,1-3H3/b7-5-
InChIKeyGZNIKZZNXXWXTC-ALCCZGGFSA-N
XLogP0.70
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'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 1-[(2Z)-2-butan-2-ylidenehydrazinyl]ethanol?
The IUPAC name of 1-[(2Z)-2-butan-2-ylidenehydrazinyl]ethanol (CID 129044868) is 1-[(2Z)-2-butan-2-ylidenehydrazinyl]ethanol.
What is the SMILES notation for 1-[(2Z)-2-butan-2-ylidenehydrazinyl]ethanol?
The canonical SMILES for 1-[(2Z)-2-butan-2-ylidenehydrazinyl]ethanol is CC/C(C)=N\NC(C)O.
What is the InChIKey of 1-[(2Z)-2-butan-2-ylidenehydrazinyl]ethanol?
The InChIKey is GZNIKZZNXXWXTC-ALCCZGGFSA-N. The full InChI is InChI=1S/C6H14N2O/c1-4-5(2)7-8-6(3)9/h6,8-9H,4H2,1-3H3/b7-5-.
What are the key properties of 1-[(2Z)-2-butan-2-ylidenehydrazinyl]ethanol?
1-[(2Z)-2-butan-2-ylidenehydrazinyl]ethanol has a molecular weight of 130.19 g/mol, XLogP of 0.70, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2Z)-2-butan-2-ylidenehydrazinyl]ethanol is sourced from PubChem (CID 129044868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).