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

C6H12N2O — CID 18424014

IUPACN'-ethyl-2-methylprop-2-enehydrazide
SMILESC=C(C)C(=O)NNCC
InChIInChI=1S/C6H12N2O/c1-4-7-8-6(9)5(2)3/h7H,2,4H2,1,3H3,(H,8,9)
InChIKeyJTGIOMTUXVHYII-UHFFFAOYSA-N
MW128.17 g/mol
LogP0.20
Rot. Bonds3

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

N'-ethyl-2-methylprop-2-enehydrazide (PubChem CID 18424014) has the molecular formula C6H12N2O and a molecular weight of 128.17 g/mol. Its IUPAC name is N'-ethyl-2-methylprop-2-enehydrazide.

Molecular Properties

Compound NameN'-ethyl-2-methylprop-2-enehydrazide
PubChem CID18424014
Molecular FormulaC6H12N2O
Molecular Weight128.17 g/mol
Exact Mass128.09
IUPAC NameN'-ethyl-2-methylprop-2-enehydrazide
SMILESC=C(C)C(=O)NNCC
InChIInChI=1S/C6H12N2O/c1-4-7-8-6(9)5(2)3/h7H,2,4H2,1,3H3,(H,8,9)
InChIKeyJTGIOMTUXVHYII-UHFFFAOYSA-N
XLogP0.20
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.17
LogP ≤ 50.20
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'-ethyl-2-methylidenehexanehydrazide
CID 87503884
N'-benzyl-2-methylprop-2-enehydrazide
CID 175049559
N'-(2-aminoacetyl)-2-methylprop-2-enehydrazide;hydrochloride
CID 18998007
2-methyl-N-propylprop-2-enamide;hydrobromide
CID 172725706
2-methyl-N-propylprop-2-enamide;hydrochloride
CID 87485783
2-methyl-N-[N-(2-methylprop-2-enoyl)carbamimidoyl]prop-2-enamide
CID 154307260
N-[3-(ethylamino)-3-oxopropyl]-2-methylprop-2-enamide
CID 87413297
2-methyl-N'-(4-phenylbutyl)prop-2-enehydrazide
CID 67732618
3-methyl-N'-(2-methylprop-2-enoyl)but-2-enehydrazide
CID 139963351
N,2-dimethylprop-2-enamide;ethane
CID 142291054
2-methyl-N-(2-methylprop-2-enoylcarbamoyl)prop-2-enamide
CID 14817903
[1-hydroxy-1-(2-methylprop-2-enoylamino)propyl]-trimethylazanium
CID 87578261

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-2-methylprop-2-enehydrazide?
The IUPAC name of N'-ethyl-2-methylprop-2-enehydrazide (CID 18424014) is N'-ethyl-2-methylprop-2-enehydrazide.
What is the SMILES notation for N'-ethyl-2-methylprop-2-enehydrazide?
The canonical SMILES for N'-ethyl-2-methylprop-2-enehydrazide is C=C(C)C(=O)NNCC.
What is the InChIKey of N'-ethyl-2-methylprop-2-enehydrazide?
The InChIKey is JTGIOMTUXVHYII-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O/c1-4-7-8-6(9)5(2)3/h7H,2,4H2,1,3H3,(H,8,9).
What are the key properties of N'-ethyl-2-methylprop-2-enehydrazide?
N'-ethyl-2-methylprop-2-enehydrazide has a molecular weight of 128.17 g/mol, XLogP of 0.20, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-2-methylprop-2-enehydrazide is sourced from PubChem (CID 18424014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).