1-(3-pyrrolidin-2-ylpropyl)indazole

C14H19N3 — CID 62480133

IUPAC1-(3-pyrrolidin-2-ylpropyl)indazole
SMILESc1ccc2c(c1)cnn2CCCC1CCCN1
InChIInChI=1S/C14H19N3/c1-2-8-14-12(5-1)11-16-17(14)10-4-7-13-6-3-9-15-13/h1-2,5,8,11,13,15H,3-4,6-7,9-10H2
InChIKeyKVJKKUCRFCTQFZ-UHFFFAOYSA-N
MW229.33 g/mol
LogP2.57
Rot. Bonds4

About 1-(3-pyrrolidin-2-ylpropyl)indazole

1-(3-pyrrolidin-2-ylpropyl)indazole (PubChem CID 62480133) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is 1-(3-pyrrolidin-2-ylpropyl)indazole.

Molecular Properties

Compound Name1-(3-pyrrolidin-2-ylpropyl)indazole
PubChem CID62480133
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name1-(3-pyrrolidin-2-ylpropyl)indazole
SMILESc1ccc2c(c1)cnn2CCCC1CCCN1
InChIInChI=1S/C14H19N3/c1-2-8-14-12(5-1)11-16-17(14)10-4-7-13-6-3-9-15-13/h1-2,5,8,11,13,15H,3-4,6-7,9-10H2
InChIKeyKVJKKUCRFCTQFZ-UHFFFAOYSA-N
XLogP2.57
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-pyrrolidin-2-ylpropyl)indazole?
The IUPAC name of 1-(3-pyrrolidin-2-ylpropyl)indazole (CID 62480133) is 1-(3-pyrrolidin-2-ylpropyl)indazole.
What is the SMILES notation for 1-(3-pyrrolidin-2-ylpropyl)indazole?
The canonical SMILES for 1-(3-pyrrolidin-2-ylpropyl)indazole is c1ccc2c(c1)cnn2CCCC1CCCN1.
What is the InChIKey of 1-(3-pyrrolidin-2-ylpropyl)indazole?
The InChIKey is KVJKKUCRFCTQFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-2-8-14-12(5-1)11-16-17(14)10-4-7-13-6-3-9-15-13/h1-2,5,8,11,13,15H,3-4,6-7,9-10H2.
What are the key properties of 1-(3-pyrrolidin-2-ylpropyl)indazole?
1-(3-pyrrolidin-2-ylpropyl)indazole has a molecular weight of 229.33 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-pyrrolidin-2-ylpropyl)indazole is sourced from PubChem (CID 62480133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).