1-(4-ethylphenyl)-5-[(Z)-2-pyrrolidin-1-ylethenyl]tetrazole

C15H19N5 — CID 92965167

IUPAC1-(4-ethylphenyl)-5-[(Z)-2-pyrrolidin-1-ylethenyl]tetrazole
SMILESCCc1ccc(-n2nnnc2/C=C\N2CCCC2)cc1
InChIInChI=1S/C15H19N5/c1-2-13-5-7-14(8-6-13)20-15(16-17-18-20)9-12-19-10-3-4-11-19/h5-9,12H,2-4,10-11H2,1H3/b12-9-
InChIKeyUEOWPYAHUIBDLR-XFXZXTDPSA-N
MW269.35 g/mol
LogP2.29
Rot. Bonds4

About 1-(4-ethylphenyl)-5-[(Z)-2-pyrrolidin-1-ylethenyl]tetrazole

1-(4-ethylphenyl)-5-[(Z)-2-pyrrolidin-1-ylethenyl]tetrazole (PubChem CID 92965167) has the molecular formula C15H19N5 and a molecular weight of 269.35 g/mol. Its IUPAC name is 1-(4-ethylphenyl)-5-[(Z)-2-pyrrolidin-1-ylethenyl]tetrazole.

Molecular Properties

Compound Name1-(4-ethylphenyl)-5-[(Z)-2-pyrrolidin-1-ylethenyl]tetrazole
PubChem CID92965167
Molecular FormulaC15H19N5
Molecular Weight269.35 g/mol
Exact Mass269.16
IUPAC Name1-(4-ethylphenyl)-5-[(Z)-2-pyrrolidin-1-ylethenyl]tetrazole
SMILESCCc1ccc(-n2nnnc2/C=C\N2CCCC2)cc1
InChIInChI=1S/C15H19N5/c1-2-13-5-7-14(8-6-13)20-15(16-17-18-20)9-12-19-10-3-4-11-19/h5-9,12H,2-4,10-11H2,1H3/b12-9-
InChIKeyUEOWPYAHUIBDLR-XFXZXTDPSA-N
XLogP2.29
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylphenyl)-5-[(Z)-2-pyrrolidin-1-ylethenyl]tetrazole?
The IUPAC name of 1-(4-ethylphenyl)-5-[(Z)-2-pyrrolidin-1-ylethenyl]tetrazole (CID 92965167) is 1-(4-ethylphenyl)-5-[(Z)-2-pyrrolidin-1-ylethenyl]tetrazole.
What is the SMILES notation for 1-(4-ethylphenyl)-5-[(Z)-2-pyrrolidin-1-ylethenyl]tetrazole?
The canonical SMILES for 1-(4-ethylphenyl)-5-[(Z)-2-pyrrolidin-1-ylethenyl]tetrazole is CCc1ccc(-n2nnnc2/C=C\N2CCCC2)cc1.
What is the InChIKey of 1-(4-ethylphenyl)-5-[(Z)-2-pyrrolidin-1-ylethenyl]tetrazole?
The InChIKey is UEOWPYAHUIBDLR-XFXZXTDPSA-N. The full InChI is InChI=1S/C15H19N5/c1-2-13-5-7-14(8-6-13)20-15(16-17-18-20)9-12-19-10-3-4-11-19/h5-9,12H,2-4,10-11H2,1H3/b12-9-.
What are the key properties of 1-(4-ethylphenyl)-5-[(Z)-2-pyrrolidin-1-ylethenyl]tetrazole?
1-(4-ethylphenyl)-5-[(Z)-2-pyrrolidin-1-ylethenyl]tetrazole has a molecular weight of 269.35 g/mol, XLogP of 2.29, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylphenyl)-5-[(Z)-2-pyrrolidin-1-ylethenyl]tetrazole is sourced from PubChem (CID 92965167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).