N'-ethyl-N-methylprop-2-enehydrazide

C6H12N2O — CID 87504219

IUPACN'-ethyl-N-methylprop-2-enehydrazide
SMILESC=CC(=O)N(C)NCC
InChIInChI=1S/C6H12N2O/c1-4-6(9)8(3)7-5-2/h4,7H,1,5H2,2-3H3
InChIKeyLAVMNOOBUBYSMS-UHFFFAOYSA-N
MW128.17 g/mol
LogP0.16
Rot. Bonds3

About N'-ethyl-N-methylprop-2-enehydrazide

N'-ethyl-N-methylprop-2-enehydrazide (PubChem CID 87504219) has the molecular formula C6H12N2O and a molecular weight of 128.17 g/mol. Its IUPAC name is N'-ethyl-N-methylprop-2-enehydrazide.

Molecular Properties

Compound NameN'-ethyl-N-methylprop-2-enehydrazide
PubChem CID87504219
Molecular FormulaC6H12N2O
Molecular Weight128.17 g/mol
Exact Mass128.09
IUPAC NameN'-ethyl-N-methylprop-2-enehydrazide
SMILESC=CC(=O)N(C)NCC
InChIInChI=1S/C6H12N2O/c1-4-6(9)8(3)7-5-2/h4,7H,1,5H2,2-3H3
InChIKeyLAVMNOOBUBYSMS-UHFFFAOYSA-N
XLogP0.16
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.17
LogP ≤ 50.16
H-Bond Donors ≤ 51
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

3-Hydroxy-1-methylpyridazin-6(1H)-one
CID 95157
1-Methyl-1H-pyrazol-5-ol
CID 10986160
1-ethyl-1H-pyrazol-3-ol
CID 10931394
N-acetyldihydropyrazole
CID 129763590
Crotonic 2,2-dimethylhydrazide
CID 21704825
d2-1-Methylpyrazolin-5-one
CID 129766688
2-ethyl-1H-pyridazine-3,6-dione
CID 12289925
Methyl-(prop-2-enoylamino)azanium chloride
CID 19086392
N'-methylprop-2-enehydrazide
CID 19086393
N,N-bis(butan-2-ylamino)prop-2-enamide
CID 19087001
Trimethyl-(prop-2-enoylamino)azanium chloride
CID 19598172
Trimethyl-(prop-2-enoylamino)azanium
CID 19598173

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N-methylprop-2-enehydrazide?
The IUPAC name of N'-ethyl-N-methylprop-2-enehydrazide (CID 87504219) is N'-ethyl-N-methylprop-2-enehydrazide.
What is the SMILES notation for N'-ethyl-N-methylprop-2-enehydrazide?
The canonical SMILES for N'-ethyl-N-methylprop-2-enehydrazide is C=CC(=O)N(C)NCC.
What is the InChIKey of N'-ethyl-N-methylprop-2-enehydrazide?
The InChIKey is LAVMNOOBUBYSMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O/c1-4-6(9)8(3)7-5-2/h4,7H,1,5H2,2-3H3.
What are the key properties of N'-ethyl-N-methylprop-2-enehydrazide?
N'-ethyl-N-methylprop-2-enehydrazide has a molecular weight of 128.17 g/mol, XLogP of 0.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N-methylprop-2-enehydrazide is sourced from PubChem (CID 87504219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).