(Z)-N,N'-dimethyl-4-oxobut-2-enehydrazide

C6H10N2O2 — CID 138706048

IUPAC(Z)-N,N'-dimethyl-4-oxobut-2-enehydrazide
SMILESCNN(C)C(=O)/C=C\C=O
InChIInChI=1S/C6H10N2O2/c1-7-8(2)6(10)4-3-5-9/h3-5,7H,1-2H3/b4-3-
InChIKeyCEOUSIAFQVBNDC-ARJAWSKDSA-N
MW142.16 g/mol
LogP-0.67
Rot. Bonds3

About (Z)-N,N'-dimethyl-4-oxobut-2-enehydrazide

(Z)-N,N'-dimethyl-4-oxobut-2-enehydrazide (PubChem CID 138706048) has the molecular formula C6H10N2O2 and a molecular weight of 142.16 g/mol. Its IUPAC name is (Z)-N,N'-dimethyl-4-oxobut-2-enehydrazide.

Molecular Properties

Compound Name(Z)-N,N'-dimethyl-4-oxobut-2-enehydrazide
PubChem CID138706048
Molecular FormulaC6H10N2O2
Molecular Weight142.16 g/mol
Exact Mass142.07
IUPAC Name(Z)-N,N'-dimethyl-4-oxobut-2-enehydrazide
SMILESCNN(C)C(=O)/C=C\C=O
InChIInChI=1S/C6H10N2O2/c1-7-8(2)6(10)4-3-5-9/h3-5,7H,1-2H3/b4-3-
InChIKeyCEOUSIAFQVBNDC-ARJAWSKDSA-N
XLogP-0.67
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-0.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(Z)-but-2-enedial;(Z)-N-[4-(dimethylamino)phenyl]-N-methyl-4-oxobut-2-enamide
CID 145403709
(2Z)-4-(dimethylamino)penta-2,4-dienal
CID 45087254
3-hydroxy-N,N'-dimethylpropanehydrazide
CID 138612980
2-amino-N,N'-dimethylacetohydrazide;hydrochloride
CID 87949719
6-oxohepta-2,4-dienal
CID 54295604
methanol;3-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethylamino]ethoxy]ethoxy]ethoxy]ethoxy]propanal;N-methylmethanamine;(Z)-N-methyl-4-oxo-N-(2-oxoethyl)but-2-enamide
CID 171536039
(Z)-N-[(3,5-difluoro-4-methylphenyl)methyl]-N-methyl-4-oxobut-2-enamide
CID 138459893
ethane;methanamine;6-[methyl-[(Z)-4-oxobut-2-enoyl]amino]-N-(2-oxoethyl)hexanamide
CID 177148979
(E)-4-(dimethylamino)but-2-enal;(3Z)-5-(methylamino)-2-methylidenehexa-3,5-dienoic acid
CID 144832955
(Z)-N-[6-(2,5-dioxopyrrol-1-yl)hexyl]-N-methyl-4-oxobut-2-enamide
CID 163501013
(Z)-N-[3-[[1-(2,2-dimethylpropoxy)-2-methylpropan-2-yl]amino]-3-oxopropyl]-N-methyl-4-oxobut-2-enamide
CID 170966519
N-[2-[methyl-[(Z)-4-oxobut-2-enoyl]amino]ethyl]-N'-[(2S)-1-oxopropan-2-yl]hexanediamide
CID 145224405

Frequently Asked Questions

What is the IUPAC name of (Z)-N,N'-dimethyl-4-oxobut-2-enehydrazide?
The IUPAC name of (Z)-N,N'-dimethyl-4-oxobut-2-enehydrazide (CID 138706048) is (Z)-N,N'-dimethyl-4-oxobut-2-enehydrazide.
What is the SMILES notation for (Z)-N,N'-dimethyl-4-oxobut-2-enehydrazide?
The canonical SMILES for (Z)-N,N'-dimethyl-4-oxobut-2-enehydrazide is CNN(C)C(=O)/C=C\C=O.
What is the InChIKey of (Z)-N,N'-dimethyl-4-oxobut-2-enehydrazide?
The InChIKey is CEOUSIAFQVBNDC-ARJAWSKDSA-N. The full InChI is InChI=1S/C6H10N2O2/c1-7-8(2)6(10)4-3-5-9/h3-5,7H,1-2H3/b4-3-.
What are the key properties of (Z)-N,N'-dimethyl-4-oxobut-2-enehydrazide?
(Z)-N,N'-dimethyl-4-oxobut-2-enehydrazide has a molecular weight of 142.16 g/mol, XLogP of -0.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,N'-dimethyl-4-oxobut-2-enehydrazide is sourced from PubChem (CID 138706048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).