5-prop-1-enyl-3-(2-pyridin-3-ylethenyl)-1H-indazole

C17H15N3 — CID 77471558

IUPAC5-prop-1-enyl-3-(2-pyridin-3-ylethenyl)-1H-indazole
SMILESCC=Cc1ccc2[nH]nc(C=Cc3cccnc3)c2c1
InChIInChI=1S/C17H15N3/c1-2-4-13-6-8-16-15(11-13)17(20-19-16)9-7-14-5-3-10-18-12-14/h2-12H,1H3,(H,19,20)
InChIKeyLOBOMNXANNTWIV-UHFFFAOYSA-N
MW261.33 g/mol
LogP4.16
Rot. Bonds3

About 5-prop-1-enyl-3-(2-pyridin-3-ylethenyl)-1H-indazole

5-prop-1-enyl-3-(2-pyridin-3-ylethenyl)-1H-indazole (PubChem CID 77471558) has the molecular formula C17H15N3 and a molecular weight of 261.33 g/mol. Its IUPAC name is 5-prop-1-enyl-3-(2-pyridin-3-ylethenyl)-1H-indazole.

Molecular Properties

Compound Name5-prop-1-enyl-3-(2-pyridin-3-ylethenyl)-1H-indazole
PubChem CID77471558
Molecular FormulaC17H15N3
Molecular Weight261.33 g/mol
Exact Mass261.13
IUPAC Name5-prop-1-enyl-3-(2-pyridin-3-ylethenyl)-1H-indazole
SMILESCC=Cc1ccc2[nH]nc(C=Cc3cccnc3)c2c1
InChIInChI=1S/C17H15N3/c1-2-4-13-6-8-16-15(11-13)17(20-19-16)9-7-14-5-3-10-18-12-14/h2-12H,1H3,(H,19,20)
InChIKeyLOBOMNXANNTWIV-UHFFFAOYSA-N
XLogP4.16
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(E)-3-[3-(2-pyridin-3-ylethenyl)-1H-indazol-5-yl]prop-2-en-1-ol
CID 123780561
6-fluoro-3-(2-pyridin-3-ylethenyl)-1H-indazol-5-amine
CID 68933883
3-(2-phenylethenyl)-6-pyridin-3-yl-1H-indazole
CID 90971721
2,3,5,6-tetrakis[(E)-2-pyridin-3-ylethenyl]pyrazine
CID 19937846
3-[(E)-2-[3,5-bis[(E)-2-pyridin-3-ylethenyl]phenyl]ethenyl]pyridine
CID 175663425
3-[(E)-2-pyridin-3-ylethenyl]pyridine;zinc
CID 175746701
2-(5-methoxy-2,3-dihydro-1H-indol-3-yl)-N-[3-[(E)-2-pyridin-3-ylethenyl]-1H-indazol-5-yl]acetamide
CID 70320548
3-[(1E,3E)-penta-1,3-dienyl]pyridine
CID 173222237
ethane;fluoromethane;3-[(E)-2-phenylethenyl]-1H-indazole
CID 142995649
3-[(E)-2-(3-chlorophenyl)ethenyl]-1H-indazole
CID 141099178
(2'S,3R)-2'-[3-(2-pyridin-3-ylethenyl)-1H-indazol-6-yl]spiro[1H-indole-3,1'-cyclopropane]-2-one
CID 67449518
1-cyclohexyl-3-[3-[(E)-2-pyridin-3-ylethenyl]-1H-indazol-6-yl]urea
CID 54766879

Frequently Asked Questions

What is the IUPAC name of 5-prop-1-enyl-3-(2-pyridin-3-ylethenyl)-1H-indazole?
The IUPAC name of 5-prop-1-enyl-3-(2-pyridin-3-ylethenyl)-1H-indazole (CID 77471558) is 5-prop-1-enyl-3-(2-pyridin-3-ylethenyl)-1H-indazole.
What is the SMILES notation for 5-prop-1-enyl-3-(2-pyridin-3-ylethenyl)-1H-indazole?
The canonical SMILES for 5-prop-1-enyl-3-(2-pyridin-3-ylethenyl)-1H-indazole is CC=Cc1ccc2[nH]nc(C=Cc3cccnc3)c2c1.
What is the InChIKey of 5-prop-1-enyl-3-(2-pyridin-3-ylethenyl)-1H-indazole?
The InChIKey is LOBOMNXANNTWIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3/c1-2-4-13-6-8-16-15(11-13)17(20-19-16)9-7-14-5-3-10-18-12-14/h2-12H,1H3,(H,19,20).
What are the key properties of 5-prop-1-enyl-3-(2-pyridin-3-ylethenyl)-1H-indazole?
5-prop-1-enyl-3-(2-pyridin-3-ylethenyl)-1H-indazole has a molecular weight of 261.33 g/mol, XLogP of 4.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-prop-1-enyl-3-(2-pyridin-3-ylethenyl)-1H-indazole is sourced from PubChem (CID 77471558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).