N'-ethyl-N'-(2-hydroxyethyl)prop-2-enehydrazide

C7H14N2O2 — CID 87074863

IUPACN'-ethyl-N'-(2-hydroxyethyl)prop-2-enehydrazide
SMILESC=CC(=O)NN(CC)CCO
InChIInChI=1S/C7H14N2O2/c1-3-7(11)8-9(4-2)5-6-10/h3,10H,1,4-6H2,2H3,(H,8,11)
InChIKeySWFOQLLCFDKSPC-UHFFFAOYSA-N
MW158.20 g/mol
LogP-0.48
Rot. Bonds5

About N'-ethyl-N'-(2-hydroxyethyl)prop-2-enehydrazide

N'-ethyl-N'-(2-hydroxyethyl)prop-2-enehydrazide (PubChem CID 87074863) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is N'-ethyl-N'-(2-hydroxyethyl)prop-2-enehydrazide.

Molecular Properties

Compound NameN'-ethyl-N'-(2-hydroxyethyl)prop-2-enehydrazide
PubChem CID87074863
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC NameN'-ethyl-N'-(2-hydroxyethyl)prop-2-enehydrazide
SMILESC=CC(=O)NN(CC)CCO
InChIInChI=1S/C7H14N2O2/c1-3-7(11)8-9(4-2)5-6-10/h3,10H,1,4-6H2,2H3,(H,8,11)
InChIKeySWFOQLLCFDKSPC-UHFFFAOYSA-N
XLogP-0.48
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-0.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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'-ethyl-N'-(2-hydroxyethyl)prop-2-enehydrazide?
The IUPAC name of N'-ethyl-N'-(2-hydroxyethyl)prop-2-enehydrazide (CID 87074863) is N'-ethyl-N'-(2-hydroxyethyl)prop-2-enehydrazide.
What is the SMILES notation for N'-ethyl-N'-(2-hydroxyethyl)prop-2-enehydrazide?
The canonical SMILES for N'-ethyl-N'-(2-hydroxyethyl)prop-2-enehydrazide is C=CC(=O)NN(CC)CCO.
What is the InChIKey of N'-ethyl-N'-(2-hydroxyethyl)prop-2-enehydrazide?
The InChIKey is SWFOQLLCFDKSPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2/c1-3-7(11)8-9(4-2)5-6-10/h3,10H,1,4-6H2,2H3,(H,8,11).
What are the key properties of N'-ethyl-N'-(2-hydroxyethyl)prop-2-enehydrazide?
N'-ethyl-N'-(2-hydroxyethyl)prop-2-enehydrazide has a molecular weight of 158.20 g/mol, XLogP of -0.48, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N'-(2-hydroxyethyl)prop-2-enehydrazide is sourced from PubChem (CID 87074863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).