1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole

C13H11N3 — CID 645436

IUPAC1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole
SMILESc1ccc2c3c([nH]c2c1)-c1[nH]ncc1CC3
InChIInChI=1S/C13H11N3/c1-2-4-11-9(3-1)10-6-5-8-7-14-16-12(8)13(10)15-11/h1-4,7,15H,5-6H2,(H,14,16)
InChIKeyWQSHEPAFFTVLAP-UHFFFAOYSA-N
MW209.25 g/mol
LogP2.66
Rot. Bonds

About 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole

1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole (PubChem CID 645436) has the molecular formula C13H11N3 and a molecular weight of 209.25 g/mol. Its IUPAC name is 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole.

Molecular Properties

Compound Name1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole
PubChem CID645436
Molecular FormulaC13H11N3
Molecular Weight209.25 g/mol
Exact Mass209.10
IUPAC Name1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole
SMILESc1ccc2c3c([nH]c2c1)-c1[nH]ncc1CC3
InChIInChI=1S/C13H11N3/c1-2-4-11-9(3-1)10-6-5-8-7-14-16-12(8)13(10)15-11/h1-4,7,15H,5-6H2,(H,14,16)
InChIKeyWQSHEPAFFTVLAP-UHFFFAOYSA-N
XLogP2.66
TPSA44.47 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

Analyze 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole?
The IUPAC name of 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole (CID 645436) is 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole.
What is the SMILES notation for 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole?
The canonical SMILES for 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole is c1ccc2c3c([nH]c2c1)-c1[nH]ncc1CC3.
What is the InChIKey of 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole?
The InChIKey is WQSHEPAFFTVLAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3/c1-2-4-11-9(3-1)10-6-5-8-7-14-16-12(8)13(10)15-11/h1-4,7,15H,5-6H2,(H,14,16).
What are the key properties of 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole?
1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole has a molecular weight of 209.25 g/mol, XLogP of 2.66, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole is sourced from PubChem (CID 645436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).