1-[(3R)-pyrrolidin-3-yl]indazole

C11H13N3 — CID 94401525

IUPAC1-[(3R)-pyrrolidin-3-yl]indazole
SMILESc1ccc2c(c1)cnn2[C@@H]1CCNC1
InChIInChI=1S/C11H13N3/c1-2-4-11-9(3-1)7-13-14(11)10-5-6-12-8-10/h1-4,7,10,12H,5-6,8H2/t10-/m1/s1
InChIKeyQOPKGPZIDCLFFF-SNVBAGLBSA-N
MW187.25 g/mol
LogP1.57
Rot. Bonds1

About 1-[(3R)-pyrrolidin-3-yl]indazole

1-[(3R)-pyrrolidin-3-yl]indazole (PubChem CID 94401525) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is 1-[(3R)-pyrrolidin-3-yl]indazole.

Molecular Properties

Compound Name1-[(3R)-pyrrolidin-3-yl]indazole
PubChem CID94401525
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC Name1-[(3R)-pyrrolidin-3-yl]indazole
SMILESc1ccc2c(c1)cnn2[C@@H]1CCNC1
InChIInChI=1S/C11H13N3/c1-2-4-11-9(3-1)7-13-14(11)10-5-6-12-8-10/h1-4,7,10,12H,5-6,8H2/t10-/m1/s1
InChIKeyQOPKGPZIDCLFFF-SNVBAGLBSA-N
XLogP1.57
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(3R)-pyrrolidin-3-yl]indazole?
The IUPAC name of 1-[(3R)-pyrrolidin-3-yl]indazole (CID 94401525) is 1-[(3R)-pyrrolidin-3-yl]indazole.
What is the SMILES notation for 1-[(3R)-pyrrolidin-3-yl]indazole?
The canonical SMILES for 1-[(3R)-pyrrolidin-3-yl]indazole is c1ccc2c(c1)cnn2[C@@H]1CCNC1.
What is the InChIKey of 1-[(3R)-pyrrolidin-3-yl]indazole?
The InChIKey is QOPKGPZIDCLFFF-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H13N3/c1-2-4-11-9(3-1)7-13-14(11)10-5-6-12-8-10/h1-4,7,10,12H,5-6,8H2/t10-/m1/s1.
What are the key properties of 1-[(3R)-pyrrolidin-3-yl]indazole?
1-[(3R)-pyrrolidin-3-yl]indazole has a molecular weight of 187.25 g/mol, XLogP of 1.57, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3R)-pyrrolidin-3-yl]indazole is sourced from PubChem (CID 94401525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).