N',N'-diethylprop-2-enehydrazide

C7H14N2O — CID 58945457

IUPACN',N'-diethylprop-2-enehydrazide
SMILESC=CC(=O)NN(CC)CC
InChIInChI=1S/C7H14N2O/c1-4-7(10)8-9(5-2)6-3/h4H,1,5-6H2,2-3H3,(H,8,10)
InChIKeyOYNHHDQMLLCRCM-UHFFFAOYSA-N
MW142.20 g/mol
LogP0.55
Rot. Bonds4

About N',N'-diethylprop-2-enehydrazide

N',N'-diethylprop-2-enehydrazide (PubChem CID 58945457) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is N',N'-diethylprop-2-enehydrazide.

Molecular Properties

Compound NameN',N'-diethylprop-2-enehydrazide
PubChem CID58945457
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC NameN',N'-diethylprop-2-enehydrazide
SMILESC=CC(=O)NN(CC)CC
InChIInChI=1S/C7H14N2O/c1-4-7(10)8-9(5-2)6-3/h4H,1,5-6H2,2-3H3,(H,8,10)
InChIKeyOYNHHDQMLLCRCM-UHFFFAOYSA-N
XLogP0.55
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.55
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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Frequently Asked Questions

What is the IUPAC name of N',N'-diethylprop-2-enehydrazide?
The IUPAC name of N',N'-diethylprop-2-enehydrazide (CID 58945457) is N',N'-diethylprop-2-enehydrazide.
What is the SMILES notation for N',N'-diethylprop-2-enehydrazide?
The canonical SMILES for N',N'-diethylprop-2-enehydrazide is C=CC(=O)NN(CC)CC.
What is the InChIKey of N',N'-diethylprop-2-enehydrazide?
The InChIKey is OYNHHDQMLLCRCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-4-7(10)8-9(5-2)6-3/h4H,1,5-6H2,2-3H3,(H,8,10).
What are the key properties of N',N'-diethylprop-2-enehydrazide?
N',N'-diethylprop-2-enehydrazide has a molecular weight of 142.20 g/mol, XLogP of 0.55, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-diethylprop-2-enehydrazide is sourced from PubChem (CID 58945457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).