2-ethenyl-1,3-dihydropyrazole

C5H8N2 — CID 66712804

IUPAC2-ethenyl-1,3-dihydropyrazole
SMILESC=CN1CC=CN1
InChIInChI=1S/C5H8N2/c1-2-7-5-3-4-6-7/h2-4,6H,1,5H2
InChIKeyIJSCYIZQNHIKIU-UHFFFAOYSA-N
MW96.13 g/mol
LogP0.46
Rot. Bonds1

About 2-ethenyl-1,3-dihydropyrazole

2-ethenyl-1,3-dihydropyrazole (PubChem CID 66712804) has the molecular formula C5H8N2 and a molecular weight of 96.13 g/mol. Its IUPAC name is 2-ethenyl-1,3-dihydropyrazole.

Molecular Properties

Compound Name2-ethenyl-1,3-dihydropyrazole
PubChem CID66712804
Molecular FormulaC5H8N2
Molecular Weight96.13 g/mol
Exact Mass96.07
IUPAC Name2-ethenyl-1,3-dihydropyrazole
SMILESC=CN1CC=CN1
InChIInChI=1S/C5H8N2/c1-2-7-5-3-4-6-7/h2-4,6H,1,5H2
InChIKeyIJSCYIZQNHIKIU-UHFFFAOYSA-N
XLogP0.46
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.13
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 122585433
Fluorovinylpyrazoline
CID 129801664
Methylpyrazoline
CID 18184270
N-methyldihydropyrazole
CID 18184273
Aminopyrazoline
CID 19786523
N-vinyldiazine
CID 20188892
Azopyrazoline
CID 69680855
N-ethylpyrazoline
CID 69963377
Butylpyrazolin
CID 69963964
Cyanopyrazoline
CID 129646902
Pyrrolidinopyrazoline
CID 129670144
Bipyrazoline
CID 129676331

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-1,3-dihydropyrazole?
The IUPAC name of 2-ethenyl-1,3-dihydropyrazole (CID 66712804) is 2-ethenyl-1,3-dihydropyrazole.
What is the SMILES notation for 2-ethenyl-1,3-dihydropyrazole?
The canonical SMILES for 2-ethenyl-1,3-dihydropyrazole is C=CN1CC=CN1.
What is the InChIKey of 2-ethenyl-1,3-dihydropyrazole?
The InChIKey is IJSCYIZQNHIKIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2/c1-2-7-5-3-4-6-7/h2-4,6H,1,5H2.
What are the key properties of 2-ethenyl-1,3-dihydropyrazole?
2-ethenyl-1,3-dihydropyrazole has a molecular weight of 96.13 g/mol, XLogP of 0.46, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-1,3-dihydropyrazole is sourced from PubChem (CID 66712804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).