N'-methylprop-2-enehydrazide

C4H8N2O — CID 19086393

IUPACN'-methylprop-2-enehydrazide
SMILESC=CC(=O)NNC
InChIInChI=1S/C4H8N2O/c1-3-4(7)6-5-2/h3,5H,1H2,2H3,(H,6,7)
InChIKeyHVPWCXPBVJEMKK-UHFFFAOYSA-N
MW100.12 g/mol
LogP-0.58
Rot. Bonds2

About N'-methylprop-2-enehydrazide

N'-methylprop-2-enehydrazide (PubChem CID 19086393) has the molecular formula C4H8N2O and a molecular weight of 100.12 g/mol. Its IUPAC name is N'-methylprop-2-enehydrazide.

Molecular Properties

Compound NameN'-methylprop-2-enehydrazide
PubChem CID19086393
Molecular FormulaC4H8N2O
Molecular Weight100.12 g/mol
Exact Mass100.06
IUPAC NameN'-methylprop-2-enehydrazide
SMILESC=CC(=O)NNC
InChIInChI=1S/C4H8N2O/c1-3-4(7)6-5-2/h3,5H,1H2,2H3,(H,6,7)
InChIKeyHVPWCXPBVJEMKK-UHFFFAOYSA-N
XLogP-0.58
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.12
LogP ≤ 5-0.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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

N'-(prop-2-enoylamino)prop-2-enehydrazide
CID 19028369
methanol;bis(N-methylprop-2-enamide)
CID 175170531
N',3-dimethylbut-2-enehydrazide
CID 148501677
2-hydroxy-2-(2-prop-2-enoylhydrazinyl)acetic acid
CID 152650647
methylphosphonic acid;N-methylprop-2-enamide
CID 160712581
diethylalumanylium;N-methylprop-2-enamide;chloride
CID 175303125
but-1-ene;N-methylprop-2-enamide
CID 159446883
N-formylprop-2-enamide;N-methylformamide
CID 159760738
N-ethylprop-2-enamide;N-methylmethanamine
CID 22381553
sodium;benzene;hydride;N-methylprop-2-enamide
CID 173390942
N'-(1-hydroxypropyl)prop-2-enehydrazide
CID 140549480
N,N-dimethylacetamide;N-methylprop-2-enamide
CID 174991436

Frequently Asked Questions

What is the IUPAC name of N'-methylprop-2-enehydrazide?
The IUPAC name of N'-methylprop-2-enehydrazide (CID 19086393) is N'-methylprop-2-enehydrazide.
What is the SMILES notation for N'-methylprop-2-enehydrazide?
The canonical SMILES for N'-methylprop-2-enehydrazide is C=CC(=O)NNC.
What is the InChIKey of N'-methylprop-2-enehydrazide?
The InChIKey is HVPWCXPBVJEMKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2O/c1-3-4(7)6-5-2/h3,5H,1H2,2H3,(H,6,7).
What are the key properties of N'-methylprop-2-enehydrazide?
N'-methylprop-2-enehydrazide has a molecular weight of 100.12 g/mol, XLogP of -0.58, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methylprop-2-enehydrazide is sourced from PubChem (CID 19086393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).