N',N'-di(propan-2-yl)prop-2-enehydrazide

C9H18N2O — CID 152617052

IUPACN',N'-di(propan-2-yl)prop-2-enehydrazide
SMILESC=CC(=O)NN(C(C)C)C(C)C
InChIInChI=1S/C9H18N2O/c1-6-9(12)10-11(7(2)3)8(4)5/h6-8H,1H2,2-5H3,(H,10,12)
InChIKeyZASUHDCBRSPJIA-UHFFFAOYSA-N
MW170.26 g/mol
LogP1.32
Rot. Bonds4

About N',N'-di(propan-2-yl)prop-2-enehydrazide

N',N'-di(propan-2-yl)prop-2-enehydrazide (PubChem CID 152617052) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is N',N'-di(propan-2-yl)prop-2-enehydrazide.

Molecular Properties

Compound NameN',N'-di(propan-2-yl)prop-2-enehydrazide
PubChem CID152617052
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC NameN',N'-di(propan-2-yl)prop-2-enehydrazide
SMILESC=CC(=O)NN(C(C)C)C(C)C
InChIInChI=1S/C9H18N2O/c1-6-9(12)10-11(7(2)3)8(4)5/h6-8H,1H2,2-5H3,(H,10,12)
InChIKeyZASUHDCBRSPJIA-UHFFFAOYSA-N
XLogP1.32
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 51.32
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

N,N-diallyl-N'-acetylhydrazine
CID 12113025
N,N-bis(butan-2-ylamino)prop-2-enamide
CID 19087001
Trimethyl-(prop-2-enoylamino)azanium
CID 19598173
N',N'-bis(prop-2-enyl)propanehydrazide
CID 20437800
N',N'-dimethylprop-2-enehydrazide
CID 22020427
N'-methyl-N'-propylprop-2-enehydrazide
CID 23187780
N'-tert-butyl-N-propylprop-2-enehydrazide
CID 53914607
Dimethyl-(prop-2-enoylamino)-propylazanium
CID 54001668
Ethyl-dimethyl-(prop-2-enoylamino)azanium
CID 54552793
Methyl-(propanoylamino)-bis(prop-2-enyl)azanium
CID 57048838
N',N'-diethylprop-2-enehydrazide
CID 58945457
Cyclopropane;trimethyl-(prop-2-enoylamino)azanium
CID 70524637

Frequently Asked Questions

What is the IUPAC name of N',N'-di(propan-2-yl)prop-2-enehydrazide?
The IUPAC name of N',N'-di(propan-2-yl)prop-2-enehydrazide (CID 152617052) is N',N'-di(propan-2-yl)prop-2-enehydrazide.
What is the SMILES notation for N',N'-di(propan-2-yl)prop-2-enehydrazide?
The canonical SMILES for N',N'-di(propan-2-yl)prop-2-enehydrazide is C=CC(=O)NN(C(C)C)C(C)C.
What is the InChIKey of N',N'-di(propan-2-yl)prop-2-enehydrazide?
The InChIKey is ZASUHDCBRSPJIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-6-9(12)10-11(7(2)3)8(4)5/h6-8H,1H2,2-5H3,(H,10,12).
What are the key properties of N',N'-di(propan-2-yl)prop-2-enehydrazide?
N',N'-di(propan-2-yl)prop-2-enehydrazide has a molecular weight of 170.26 g/mol, XLogP of 1.32, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-di(propan-2-yl)prop-2-enehydrazide is sourced from PubChem (CID 152617052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).