5-[(Z)-1-ethenoxyprop-1-enyl]-1H-pyrazole

C8H10N2O — CID 143157879

IUPAC5-[(Z)-1-ethenoxyprop-1-enyl]-1H-pyrazole
SMILESC=CO/C(=C\C)c1ccn[nH]1
InChIInChI=1S/C8H10N2O/c1-3-8(11-4-2)7-5-6-9-10-7/h3-6H,2H2,1H3,(H,9,10)/b8-3-
InChIKeyGCJQFGVDTVFBKA-BAQGIRSFSA-N
MW150.18 g/mol
LogP1.93
Rot. Bonds3

About 5-[(Z)-1-ethenoxyprop-1-enyl]-1H-pyrazole

5-[(Z)-1-ethenoxyprop-1-enyl]-1H-pyrazole (PubChem CID 143157879) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is 5-[(Z)-1-ethenoxyprop-1-enyl]-1H-pyrazole.

Molecular Properties

Compound Name5-[(Z)-1-ethenoxyprop-1-enyl]-1H-pyrazole
PubChem CID143157879
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name5-[(Z)-1-ethenoxyprop-1-enyl]-1H-pyrazole
SMILESC=CO/C(=C\C)c1ccn[nH]1
InChIInChI=1S/C8H10N2O/c1-3-8(11-4-2)7-5-6-9-10-7/h3-6H,2H2,1H3,(H,9,10)/b8-3-
InChIKeyGCJQFGVDTVFBKA-BAQGIRSFSA-N
XLogP1.93
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

5-[(3E,5Z)-2-methylhepta-1,3,5-trien-4-yl]-1H-pyrazole
CID 143483242
ethane;3-[(Z)-1-ethenoxyprop-1-enyl]-1,2-oxazole
CID 143157807
N-[(3E,5Z)-hepta-1,3,5-trien-3-yl]-1H-pyrazole-5-carboxamide
CID 142262030
(E,2Z)-N'-methyl-2-[1-(methylideneamino)ethylidene]-3-(1H-pyrazol-5-yl)pent-3-enimidamide
CID 156730122
(Z)-1-(1H-pyrazol-5-yl)ethylidenehydrazine
CID 137269091
2-(1H-pyrazol-5-yl)prop-2-enoic acid
CID 68994792
1H-pyrazole-5-carboxylic acid;zinc
CID 158581218
carboxy 1H-pyrazole-5-carboxylate
CID 154449295
1H-pyrazole-5-carboxamide;hydrate
CID 172743817
copper(1+);1H-pyrazole-5-carboxylate
CID 70037114
(Z)-3-(dimethylamino)-2-(1H-pyrazol-5-yl)prop-2-enenitrile
CID 90112632
2,2,2-trifluoro-1-(1H-pyrazol-5-yl)ethanethione
CID 141015818

Frequently Asked Questions

What is the IUPAC name of 5-[(Z)-1-ethenoxyprop-1-enyl]-1H-pyrazole?
The IUPAC name of 5-[(Z)-1-ethenoxyprop-1-enyl]-1H-pyrazole (CID 143157879) is 5-[(Z)-1-ethenoxyprop-1-enyl]-1H-pyrazole.
What is the SMILES notation for 5-[(Z)-1-ethenoxyprop-1-enyl]-1H-pyrazole?
The canonical SMILES for 5-[(Z)-1-ethenoxyprop-1-enyl]-1H-pyrazole is C=CO/C(=C\C)c1ccn[nH]1.
What is the InChIKey of 5-[(Z)-1-ethenoxyprop-1-enyl]-1H-pyrazole?
The InChIKey is GCJQFGVDTVFBKA-BAQGIRSFSA-N. The full InChI is InChI=1S/C8H10N2O/c1-3-8(11-4-2)7-5-6-9-10-7/h3-6H,2H2,1H3,(H,9,10)/b8-3-.
What are the key properties of 5-[(Z)-1-ethenoxyprop-1-enyl]-1H-pyrazole?
5-[(Z)-1-ethenoxyprop-1-enyl]-1H-pyrazole has a molecular weight of 150.18 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(Z)-1-ethenoxyprop-1-enyl]-1H-pyrazole is sourced from PubChem (CID 143157879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).