(4E,5Z)-4-[(Z)-but-2-enylidene]-5-propylidene-1H-pyrazole

C10H14N2 — CID 167020649

IUPAC(4E,5Z)-4-[(Z)-but-2-enylidene]-5-propylidene-1H-pyrazole
SMILESC/C=C\C=c1\cn[nH]\c1=C/CC
InChIInChI=1S/C10H14N2/c1-3-5-7-9-8-11-12-10(9)6-4-2/h3,5-8,12H,4H2,1-2H3/b5-3-,9-7-,10-6-
InChIKeyMWEZPCNZXMNNAN-UIHNGTEJSA-N
MW162.24 g/mol
LogP0.96
Rot. Bonds2

About (4E,5Z)-4-[(Z)-but-2-enylidene]-5-propylidene-1H-pyrazole

(4E,5Z)-4-[(Z)-but-2-enylidene]-5-propylidene-1H-pyrazole (PubChem CID 167020649) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is (4E,5Z)-4-[(Z)-but-2-enylidene]-5-propylidene-1H-pyrazole.

Molecular Properties

Compound Name(4E,5Z)-4-[(Z)-but-2-enylidene]-5-propylidene-1H-pyrazole
PubChem CID167020649
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name(4E,5Z)-4-[(Z)-but-2-enylidene]-5-propylidene-1H-pyrazole
SMILESC/C=C\C=c1\cn[nH]\c1=C/CC
InChIInChI=1S/C10H14N2/c1-3-5-7-9-8-11-12-10(9)6-4-2/h3,5-8,12H,4H2,1-2H3/b5-3-,9-7-,10-6-
InChIKeyMWEZPCNZXMNNAN-UIHNGTEJSA-N
XLogP0.96
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(4E,5E)-5-[(Z)-but-2-enylidene]-2-methyl-4-propylidene-1H-imidazole;ethane
CID 143526405
5-prop-1-enyl-1H-pyrazol-4-amine
CID 90117424
(4E,5E)-5-[(Z)-pent-3-en-2-ylidene]-4-prop-2-enylidene-1H-pyrazole
CID 130459173
N-[(E)-(4-methylidene-1H-pyrazol-5-ylidene)methyl]ethanimine
CID 165136855
(2E,3Z)-3-[(Z)-but-2-enylidene]-2-ethylidenepyridine
CID 130370242
ethane;(4E,5E)-4-ethylidene-2-methyl-5-propylidene-1H-imidazole
CID 143453484
ethane;(4E)-5-methylidene-4-(2-methylprop-2-enylidene)-1H-pyrazole
CID 144598133
5-[(Z)-prop-1-enyl]-4-prop-1-en-2-yl-1H-pyrazole
CID 155741579
(5E)-5-[(Z)-but-2-enylidene]-1-methyl-4-methylidenepyrazole;ethane
CID 145336020
5-[(Z)-but-1-enyl]-4-ethenyl-1H-pyrazole
CID 167231357
(4E,5E)-4-but-3-en-2-ylidene-5-ethylidene-1H-pyrazole;ethane
CID 143334506
(3E,4Z)-3-prop-2-enylidene-4-propylidenepyridine
CID 139406239

Frequently Asked Questions

What is the IUPAC name of (4E,5Z)-4-[(Z)-but-2-enylidene]-5-propylidene-1H-pyrazole?
The IUPAC name of (4E,5Z)-4-[(Z)-but-2-enylidene]-5-propylidene-1H-pyrazole (CID 167020649) is (4E,5Z)-4-[(Z)-but-2-enylidene]-5-propylidene-1H-pyrazole.
What is the SMILES notation for (4E,5Z)-4-[(Z)-but-2-enylidene]-5-propylidene-1H-pyrazole?
The canonical SMILES for (4E,5Z)-4-[(Z)-but-2-enylidene]-5-propylidene-1H-pyrazole is C/C=C\C=c1\cn[nH]\c1=C/CC.
What is the InChIKey of (4E,5Z)-4-[(Z)-but-2-enylidene]-5-propylidene-1H-pyrazole?
The InChIKey is MWEZPCNZXMNNAN-UIHNGTEJSA-N. The full InChI is InChI=1S/C10H14N2/c1-3-5-7-9-8-11-12-10(9)6-4-2/h3,5-8,12H,4H2,1-2H3/b5-3-,9-7-,10-6-.
What are the key properties of (4E,5Z)-4-[(Z)-but-2-enylidene]-5-propylidene-1H-pyrazole?
(4E,5Z)-4-[(Z)-but-2-enylidene]-5-propylidene-1H-pyrazole has a molecular weight of 162.24 g/mol, XLogP of 0.96, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4E,5Z)-4-[(Z)-but-2-enylidene]-5-propylidene-1H-pyrazole is sourced from PubChem (CID 167020649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).