(Z)-4-N-methylbut-2-enedihydrazide

C5H10N4O2 — CID 98044656

IUPAC(Z)-4-N-methylbut-2-enedihydrazide
SMILESCN(N)C(=O)/C=C\C(=O)NN
InChIInChI=1S/C5H10N4O2/c1-9(7)5(11)3-2-4(10)8-6/h2-3H,6-7H2,1H3,(H,8,10)/b3-2-
InChIKeyVOJJYIHDPUIINR-IHWYPQMZSA-N
MW158.16 g/mol
LogP-2.14
Rot. Bonds2

About (Z)-4-N-methylbut-2-enedihydrazide

(Z)-4-N-methylbut-2-enedihydrazide (PubChem CID 98044656) has the molecular formula C5H10N4O2 and a molecular weight of 158.16 g/mol. Its IUPAC name is (Z)-4-N-methylbut-2-enedihydrazide.

Molecular Properties

Compound Name(Z)-4-N-methylbut-2-enedihydrazide
PubChem CID98044656
Molecular FormulaC5H10N4O2
Molecular Weight158.16 g/mol
Exact Mass158.08
IUPAC Name(Z)-4-N-methylbut-2-enedihydrazide
SMILESCN(N)C(=O)/C=C\C(=O)NN
InChIInChI=1S/C5H10N4O2/c1-9(7)5(11)3-2-4(10)8-6/h2-3H,6-7H2,1H3,(H,8,10)/b3-2-
InChIKeyVOJJYIHDPUIINR-IHWYPQMZSA-N
XLogP-2.14
TPSA101.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.16
LogP ≤ 5-2.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_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 (Z)-4-N-methylbut-2-enedihydrazide?
The IUPAC name of (Z)-4-N-methylbut-2-enedihydrazide (CID 98044656) is (Z)-4-N-methylbut-2-enedihydrazide.
What is the SMILES notation for (Z)-4-N-methylbut-2-enedihydrazide?
The canonical SMILES for (Z)-4-N-methylbut-2-enedihydrazide is CN(N)C(=O)/C=C\C(=O)NN.
What is the InChIKey of (Z)-4-N-methylbut-2-enedihydrazide?
The InChIKey is VOJJYIHDPUIINR-IHWYPQMZSA-N. The full InChI is InChI=1S/C5H10N4O2/c1-9(7)5(11)3-2-4(10)8-6/h2-3H,6-7H2,1H3,(H,8,10)/b3-2-.
What are the key properties of (Z)-4-N-methylbut-2-enedihydrazide?
(Z)-4-N-methylbut-2-enedihydrazide has a molecular weight of 158.16 g/mol, XLogP of -2.14, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-N-methylbut-2-enedihydrazide is sourced from PubChem (CID 98044656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).