5-ethenyl-4-[(Z)-prop-1-enyl]-3H-pyrazole

C8H10N2 — CID 142078693

IUPAC5-ethenyl-4-[(Z)-prop-1-enyl]-3H-pyrazole
SMILESC=CC1=C(/C=C\C)CN=N1
InChIInChI=1S/C8H10N2/c1-3-5-7-6-9-10-8(7)4-2/h3-5H,2,6H2,1H3/b5-3-
InChIKeyNNHVHAVLRGENTB-HYXAFXHYSA-N
MW134.18 g/mol
LogP2.47
Rot. Bonds2

About 5-ethenyl-4-[(Z)-prop-1-enyl]-3H-pyrazole

5-ethenyl-4-[(Z)-prop-1-enyl]-3H-pyrazole (PubChem CID 142078693) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is 5-ethenyl-4-[(Z)-prop-1-enyl]-3H-pyrazole.

Molecular Properties

Compound Name5-ethenyl-4-[(Z)-prop-1-enyl]-3H-pyrazole
PubChem CID142078693
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC Name5-ethenyl-4-[(Z)-prop-1-enyl]-3H-pyrazole
SMILESC=CC1=C(/C=C\C)CN=N1
InChIInChI=1S/C8H10N2/c1-3-5-7-6-9-10-8(7)4-2/h3-5H,2,6H2,1H3/b5-3-
InChIKeyNNHVHAVLRGENTB-HYXAFXHYSA-N
XLogP2.47
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-4-[(Z)-prop-1-enyl]-3H-pyrazole?
The IUPAC name of 5-ethenyl-4-[(Z)-prop-1-enyl]-3H-pyrazole (CID 142078693) is 5-ethenyl-4-[(Z)-prop-1-enyl]-3H-pyrazole.
What is the SMILES notation for 5-ethenyl-4-[(Z)-prop-1-enyl]-3H-pyrazole?
The canonical SMILES for 5-ethenyl-4-[(Z)-prop-1-enyl]-3H-pyrazole is C=CC1=C(/C=C\C)CN=N1.
What is the InChIKey of 5-ethenyl-4-[(Z)-prop-1-enyl]-3H-pyrazole?
The InChIKey is NNHVHAVLRGENTB-HYXAFXHYSA-N. The full InChI is InChI=1S/C8H10N2/c1-3-5-7-6-9-10-8(7)4-2/h3-5H,2,6H2,1H3/b5-3-.
What are the key properties of 5-ethenyl-4-[(Z)-prop-1-enyl]-3H-pyrazole?
5-ethenyl-4-[(Z)-prop-1-enyl]-3H-pyrazole has a molecular weight of 134.18 g/mol, XLogP of 2.47, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-4-[(Z)-prop-1-enyl]-3H-pyrazole is sourced from PubChem (CID 142078693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).