1-[(Z)-dec-5-en-5-yl]pyrazole

C13H22N2 — CID 135080242

IUPAC1-[(Z)-dec-5-en-5-yl]pyrazole
SMILESCCCC/C=C(/CCCC)n1cccn1
InChIInChI=1S/C13H22N2/c1-3-5-7-10-13(9-6-4-2)15-12-8-11-14-15/h8,10-12H,3-7,9H2,1-2H3/b13-10-
InChIKeyODSOJMVLTZQGCN-RAXLEYEMSA-N
MW206.33 g/mol
LogP4.10
Rot. Bonds7

About 1-[(Z)-dec-5-en-5-yl]pyrazole

1-[(Z)-dec-5-en-5-yl]pyrazole (PubChem CID 135080242) has the molecular formula C13H22N2 and a molecular weight of 206.33 g/mol. Its IUPAC name is 1-[(Z)-dec-5-en-5-yl]pyrazole.

Molecular Properties

Compound Name1-[(Z)-dec-5-en-5-yl]pyrazole
PubChem CID135080242
Molecular FormulaC13H22N2
Molecular Weight206.33 g/mol
Exact Mass206.18
IUPAC Name1-[(Z)-dec-5-en-5-yl]pyrazole
SMILESCCCC/C=C(/CCCC)n1cccn1
InChIInChI=1S/C13H22N2/c1-3-5-7-10-13(9-6-4-2)15-12-8-11-14-15/h8,10-12H,3-7,9H2,1-2H3/b13-10-
InChIKeyODSOJMVLTZQGCN-RAXLEYEMSA-N
XLogP4.10
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-cyclopentyl-1H-pyrazole
CID 10844435
3-Ethyl-1-methyl-1H-pyrazole
CID 12581083
1-butyl-1H-pyrazole
CID 142906
N-decylpyrazole
CID 10889133
1-Pentyl-1H-pyrazole
CID 12711093
1-Heptylpyrazole
CID 12711094
1-Isopropenylpyrazole
CID 21593523
1-ethyl-3-methyl-1H-pyrazole
CID 12002774
1,3-Dibutylpyrazole
CID 19604005
1-butyl-3-methyl-1H-pyrazole
CID 23006149
1,3-Diethyl-1H-pyrazole
CID 23006152
3-Ethyl-1-propyl-1H-pyrazole
CID 23006154

Frequently Asked Questions

What is the IUPAC name of 1-[(Z)-dec-5-en-5-yl]pyrazole?
The IUPAC name of 1-[(Z)-dec-5-en-5-yl]pyrazole (CID 135080242) is 1-[(Z)-dec-5-en-5-yl]pyrazole.
What is the SMILES notation for 1-[(Z)-dec-5-en-5-yl]pyrazole?
The canonical SMILES for 1-[(Z)-dec-5-en-5-yl]pyrazole is CCCC/C=C(/CCCC)n1cccn1.
What is the InChIKey of 1-[(Z)-dec-5-en-5-yl]pyrazole?
The InChIKey is ODSOJMVLTZQGCN-RAXLEYEMSA-N. The full InChI is InChI=1S/C13H22N2/c1-3-5-7-10-13(9-6-4-2)15-12-8-11-14-15/h8,10-12H,3-7,9H2,1-2H3/b13-10-.
What are the key properties of 1-[(Z)-dec-5-en-5-yl]pyrazole?
1-[(Z)-dec-5-en-5-yl]pyrazole has a molecular weight of 206.33 g/mol, XLogP of 4.10, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z)-dec-5-en-5-yl]pyrazole is sourced from PubChem (CID 135080242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).