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

C13H10ClN3 — CID 135453860

IUPAC6-chloro-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole
SMILESClc1cccc2[nH]c3c(c12)CCc1cn[nH]c1-3
InChIInChI=1S/C13H10ClN3/c14-9-2-1-3-10-11(9)8-5-4-7-6-15-17-12(7)13(8)16-10/h1-3,6,16H,4-5H2,(H,15,17)
InChIKeyJKLTYLMWDNSYTE-UHFFFAOYSA-N
MW243.70 g/mol
LogP3.31
Rot. Bonds

About 6-chloro-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole

6-chloro-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole (PubChem CID 135453860) has the molecular formula C13H10ClN3 and a molecular weight of 243.70 g/mol. Its IUPAC name is 6-chloro-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole.

Molecular Properties

Compound Name6-chloro-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole
PubChem CID135453860
Molecular FormulaC13H10ClN3
Molecular Weight243.70 g/mol
Exact Mass243.06
IUPAC Name6-chloro-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole
SMILESClc1cccc2[nH]c3c(c12)CCc1cn[nH]c1-3
InChIInChI=1S/C13H10ClN3/c14-9-2-1-3-10-11(9)8-5-4-7-6-15-17-12(7)13(8)16-10/h1-3,6,16H,4-5H2,(H,15,17)
InChIKeyJKLTYLMWDNSYTE-UHFFFAOYSA-N
XLogP3.31
TPSA44.47 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.70
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

2,4,5,10-Tetrahydropyrazolo[3,4-a]carbazole
CID 645436
4,5,6,11-Tetrahydro-1h-Pyrazolo[4',3':6,7]cyclohepta[1,2-B]indole
CID 135566619
7-Methyl-1,2,4,5-tetrahydropyrazolo[3,4-a]carbazole
CID 659102
7-Chloro-1,2,4,5-tetrahydropyrazolo[3,4-a]carbazole
CID 829981
3-(6-chloropyridazin-3-yl)-1H-indole
CID 2763611
5-Methyl-3,4,16-triazatetracyclo[7.7.0.0^{2,6}.0^{10,15}]hexadeca-1(9),2,5,10,12,14-hexaene
CID 135929094
5-Cyclopropyl-3,4,16-triazatetracyclo[7.7.0.0^{2,6}.0^{10,15}]hexadeca-1(9),2,5,10,12,14-hexaene
CID 135929095
7,10-Dimethyl-2,4,5,10-tetrahydropyrazolo[3,4-a]carbazole
CID 1207791
N-(1-(2-chlorobenzyl)pyrrolidin-3-yl)-1H-indazol-5-amine
CID 21098469
5-(1-(2-chlorobenzyl)-1H-1,2,3-triazol-4-yl)-1H-indazole
CID 25166059
1,4,5,10-Tetrahydropyrazolo[5,4-a]carbazole-7-carbonitrile
CID 135449041
8-Chloro-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole
CID 135453861

Frequently Asked Questions

What is the IUPAC name of 6-chloro-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole?
The IUPAC name of 6-chloro-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole (CID 135453860) is 6-chloro-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole.
What is the SMILES notation for 6-chloro-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole?
The canonical SMILES for 6-chloro-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole is Clc1cccc2[nH]c3c(c12)CCc1cn[nH]c1-3.
What is the InChIKey of 6-chloro-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole?
The InChIKey is JKLTYLMWDNSYTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClN3/c14-9-2-1-3-10-11(9)8-5-4-7-6-15-17-12(7)13(8)16-10/h1-3,6,16H,4-5H2,(H,15,17).
What are the key properties of 6-chloro-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole?
6-chloro-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole has a molecular weight of 243.70 g/mol, XLogP of 3.31, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-1,4,5,10-tetrahydropyrazolo[5,4-a]carbazole is sourced from PubChem (CID 135453860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).