N',N'-diethyl-N-methylprop-2-enehydrazide

C8H16N2O — CID 87504103

IUPACN',N'-diethyl-N-methylprop-2-enehydrazide
SMILESC=CC(=O)N(C)N(CC)CC
InChIInChI=1S/C8H16N2O/c1-5-8(11)9(4)10(6-2)7-3/h5H,1,6-7H2,2-4H3
InChIKeyPLRMFQMWABFOFZ-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.89
Rot. Bonds4

About N',N'-diethyl-N-methylprop-2-enehydrazide

N',N'-diethyl-N-methylprop-2-enehydrazide (PubChem CID 87504103) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is N',N'-diethyl-N-methylprop-2-enehydrazide.

Molecular Properties

Compound NameN',N'-diethyl-N-methylprop-2-enehydrazide
PubChem CID87504103
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC NameN',N'-diethyl-N-methylprop-2-enehydrazide
SMILESC=CC(=O)N(C)N(CC)CC
InChIInChI=1S/C8H16N2O/c1-5-8(11)9(4)10(6-2)7-3/h5H,1,6-7H2,2-4H3
InChIKeyPLRMFQMWABFOFZ-UHFFFAOYSA-N
XLogP0.89
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.89
H-Bond Donors ≤ 50
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,n-Dimethylamino propyl acrylamide
CID 19096916
N,N-diethyl acrylamide N,N-dimethylacrylamide
CID 86674667
Dimethylamino ethyl acrylamide
CID 87059356
Acrylic 2,2-dimethyl-1-vinylhydrazide
CID 15525103
N,N',N'-trimethylprop-2-enehydrazide
CID 12623513
Trimethyl-[methyl(prop-2-enoyl)amino]azanium chloride
CID 19380335
Trimethyl-[prop-2-enoyl(propyl)amino]azanium
CID 19604698
N-(2,2-dimethylpropyl)-N',N'-dimethylprop-2-enehydrazide
CID 19933790
N',N'-dimethyl-N-propan-2-ylprop-2-enehydrazide
CID 20215341
N',N'-diethyl-N-propan-2-ylprop-2-enehydrazide
CID 20215350
N-butyl-N',N'-diethylprop-2-enehydrazide
CID 54122633
N,N',N'-triethylprop-2-enehydrazide
CID 57110230

Frequently Asked Questions

What is the IUPAC name of N',N'-diethyl-N-methylprop-2-enehydrazide?
The IUPAC name of N',N'-diethyl-N-methylprop-2-enehydrazide (CID 87504103) is N',N'-diethyl-N-methylprop-2-enehydrazide.
What is the SMILES notation for N',N'-diethyl-N-methylprop-2-enehydrazide?
The canonical SMILES for N',N'-diethyl-N-methylprop-2-enehydrazide is C=CC(=O)N(C)N(CC)CC.
What is the InChIKey of N',N'-diethyl-N-methylprop-2-enehydrazide?
The InChIKey is PLRMFQMWABFOFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-5-8(11)9(4)10(6-2)7-3/h5H,1,6-7H2,2-4H3.
What are the key properties of N',N'-diethyl-N-methylprop-2-enehydrazide?
N',N'-diethyl-N-methylprop-2-enehydrazide has a molecular weight of 156.23 g/mol, XLogP of 0.89, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-diethyl-N-methylprop-2-enehydrazide is sourced from PubChem (CID 87504103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).