N'-methoxy-N'-methylbut-2-enehydrazide

C6H12N2O2 — CID 155059177

IUPACN'-methoxy-N'-methylbut-2-enehydrazide
SMILESCC=CC(=O)NN(C)OC
InChIInChI=1S/C6H12N2O2/c1-4-5-6(9)7-8(2)10-3/h4-5H,1-3H3,(H,7,9)
InChIKeyOYNJKFJDLQGPQS-UHFFFAOYSA-N
MW144.17 g/mol
LogP0.09
Rot. Bonds3

About N'-methoxy-N'-methylbut-2-enehydrazide

N'-methoxy-N'-methylbut-2-enehydrazide (PubChem CID 155059177) has the molecular formula C6H12N2O2 and a molecular weight of 144.17 g/mol. Its IUPAC name is N'-methoxy-N'-methylbut-2-enehydrazide.

Molecular Properties

Compound NameN'-methoxy-N'-methylbut-2-enehydrazide
PubChem CID155059177
Molecular FormulaC6H12N2O2
Molecular Weight144.17 g/mol
Exact Mass144.09
IUPAC NameN'-methoxy-N'-methylbut-2-enehydrazide
SMILESCC=CC(=O)NN(C)OC
InChIInChI=1S/C6H12N2O2/c1-4-5-6(9)7-8(2)10-3/h4-5H,1-3H3,(H,7,9)
InChIKeyOYNJKFJDLQGPQS-UHFFFAOYSA-N
XLogP0.09
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.17
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2E,4E)-N'-methoxy-N'-methyl-5-phenylpenta-2,4-dienehydrazide
CID 125484977
methyl N-[(E)-but-2-enoyl]carbamate
CID 16719385
(Z)-but-2-enedioic acid;N-methoxybut-2-enamide
CID 175709522
methyl but-2-enoate;hydrochloride
CID 174681562
N,N'-bis[(E)-but-2-enoyl]oxamide
CID 22157614
N-(trihydroxymethyl)but-2-enamide
CID 154354345
(E)-N-[1-[[(E)-but-2-enoyl]amino]ethyl]but-2-enamide
CID 134844931
(Z)-N-ethenylbut-2-enamide
CID 121258309
(Z)-N-[(Z)-but-2-en-2-yl]but-2-enamide
CID 130459282
N'-[(E)-but-2-enoyl]-N-tert-butyl-2-methoxybenzohydrazide
CID 67922068
hepta-2,5-dien-4-one
CID 54179619
(but-2-enoylamino) hydrogen sulfite
CID 174802642

Frequently Asked Questions

What is the IUPAC name of N'-methoxy-N'-methylbut-2-enehydrazide?
The IUPAC name of N'-methoxy-N'-methylbut-2-enehydrazide (CID 155059177) is N'-methoxy-N'-methylbut-2-enehydrazide.
What is the SMILES notation for N'-methoxy-N'-methylbut-2-enehydrazide?
The canonical SMILES for N'-methoxy-N'-methylbut-2-enehydrazide is CC=CC(=O)NN(C)OC.
What is the InChIKey of N'-methoxy-N'-methylbut-2-enehydrazide?
The InChIKey is OYNJKFJDLQGPQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O2/c1-4-5-6(9)7-8(2)10-3/h4-5H,1-3H3,(H,7,9).
What are the key properties of N'-methoxy-N'-methylbut-2-enehydrazide?
N'-methoxy-N'-methylbut-2-enehydrazide has a molecular weight of 144.17 g/mol, XLogP of 0.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methoxy-N'-methylbut-2-enehydrazide is sourced from PubChem (CID 155059177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).