3-ethenyl-5-methylidene-4-[(Z)-prop-1-enyl]-1,2-dihydropyrazole

C9H12N2 — CID 134468708

IUPAC3-ethenyl-5-methylidene-4-[(Z)-prop-1-enyl]-1,2-dihydropyrazole
SMILESC=CC1=C(/C=C\C)C(=C)NN1
InChIInChI=1S/C9H12N2/c1-4-6-8-7(3)10-11-9(8)5-2/h4-6,10-11H,2-3H2,1H3/b6-4-
InChIKeyGFNCBJHZVONZFX-XQRVVYSFSA-N
MW148.21 g/mol
LogP1.62
Rot. Bonds2

About 3-ethenyl-5-methylidene-4-[(Z)-prop-1-enyl]-1,2-dihydropyrazole

3-ethenyl-5-methylidene-4-[(Z)-prop-1-enyl]-1,2-dihydropyrazole (PubChem CID 134468708) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is 3-ethenyl-5-methylidene-4-[(Z)-prop-1-enyl]-1,2-dihydropyrazole.

Molecular Properties

Compound Name3-ethenyl-5-methylidene-4-[(Z)-prop-1-enyl]-1,2-dihydropyrazole
PubChem CID134468708
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name3-ethenyl-5-methylidene-4-[(Z)-prop-1-enyl]-1,2-dihydropyrazole
SMILESC=CC1=C(/C=C\C)C(=C)NN1
InChIInChI=1S/C9H12N2/c1-4-6-8-7(3)10-11-9(8)5-2/h4-6,10-11H,2-3H2,1H3/b6-4-
InChIKeyGFNCBJHZVONZFX-XQRVVYSFSA-N
XLogP1.62
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethenyl-5-methylidene-4-[(Z)-prop-1-enyl]-1,2-dihydropyrazole?
The IUPAC name of 3-ethenyl-5-methylidene-4-[(Z)-prop-1-enyl]-1,2-dihydropyrazole (CID 134468708) is 3-ethenyl-5-methylidene-4-[(Z)-prop-1-enyl]-1,2-dihydropyrazole.
What is the SMILES notation for 3-ethenyl-5-methylidene-4-[(Z)-prop-1-enyl]-1,2-dihydropyrazole?
The canonical SMILES for 3-ethenyl-5-methylidene-4-[(Z)-prop-1-enyl]-1,2-dihydropyrazole is C=CC1=C(/C=C\C)C(=C)NN1.
What is the InChIKey of 3-ethenyl-5-methylidene-4-[(Z)-prop-1-enyl]-1,2-dihydropyrazole?
The InChIKey is GFNCBJHZVONZFX-XQRVVYSFSA-N. The full InChI is InChI=1S/C9H12N2/c1-4-6-8-7(3)10-11-9(8)5-2/h4-6,10-11H,2-3H2,1H3/b6-4-.
What are the key properties of 3-ethenyl-5-methylidene-4-[(Z)-prop-1-enyl]-1,2-dihydropyrazole?
3-ethenyl-5-methylidene-4-[(Z)-prop-1-enyl]-1,2-dihydropyrazole has a molecular weight of 148.21 g/mol, XLogP of 1.62, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-5-methylidene-4-[(Z)-prop-1-enyl]-1,2-dihydropyrazole is sourced from PubChem (CID 134468708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).