7,9-dichloropyrido[3,4-b]indole

C11H6Cl2N2 — CID 22185235

IUPAC7,9-dichloropyrido[3,4-b]indole
SMILESClc1ccc2c3ccncc3n(Cl)c2c1
InChIInChI=1S/C11H6Cl2N2/c12-7-1-2-8-9-3-4-14-6-11(9)15(13)10(8)5-7/h1-6H
InChIKeyRZNXOXYOSQIWDC-UHFFFAOYSA-N
MW237.09 g/mol
LogP3.84
Rot. Bonds

About 7,9-dichloropyrido[3,4-b]indole

7,9-dichloropyrido[3,4-b]indole (PubChem CID 22185235) has the molecular formula C11H6Cl2N2 and a molecular weight of 237.09 g/mol. Its IUPAC name is 7,9-dichloropyrido[3,4-b]indole.

Molecular Properties

Compound Name7,9-dichloropyrido[3,4-b]indole
PubChem CID22185235
Molecular FormulaC11H6Cl2N2
Molecular Weight237.09 g/mol
Exact Mass235.99
IUPAC Name7,9-dichloropyrido[3,4-b]indole
SMILESClc1ccc2c3ccncc3n(Cl)c2c1
InChIInChI=1S/C11H6Cl2N2/c12-7-1-2-8-9-3-4-14-6-11(9)15(13)10(8)5-7/h1-6H
InChIKeyRZNXOXYOSQIWDC-UHFFFAOYSA-N
XLogP3.84
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.09
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Beta-Carboline
CID 64961
4,7-Dichloroquinoline
CID 6866
7-Chloro-4-(1-pyrrolidinyl)quinoline
CID 962627
9H-Pyrido(3,4-b)indole, 1-methyl-, hydrochloride (1:1)
CID 5487918
2-(4-Chlorophenyl)indolizine
CID 346941
7-Chloroquinoline
CID 521963
3-chloro-9H-pyrido[3,4-b]indole
CID 6198020
7-Chloro-3-pyridin-4-yl-quinoline
CID 10354294
6,8-Dichloro-9h-pyrido[3,4-b]indole
CID 11075446
6-chloro-9H-pyrido[3,4-b]indole
CID 11287153
Nostocarboline hydroiodide
CID 11515734
N-Methoxy-1-vinyl-beta-carboline
CID 639591

Frequently Asked Questions

What is the IUPAC name of 7,9-dichloropyrido[3,4-b]indole?
The IUPAC name of 7,9-dichloropyrido[3,4-b]indole (CID 22185235) is 7,9-dichloropyrido[3,4-b]indole.
What is the SMILES notation for 7,9-dichloropyrido[3,4-b]indole?
The canonical SMILES for 7,9-dichloropyrido[3,4-b]indole is Clc1ccc2c3ccncc3n(Cl)c2c1.
What is the InChIKey of 7,9-dichloropyrido[3,4-b]indole?
The InChIKey is RZNXOXYOSQIWDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6Cl2N2/c12-7-1-2-8-9-3-4-14-6-11(9)15(13)10(8)5-7/h1-6H.
What are the key properties of 7,9-dichloropyrido[3,4-b]indole?
7,9-dichloropyrido[3,4-b]indole has a molecular weight of 237.09 g/mol, XLogP of 3.84, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7,9-dichloropyrido[3,4-b]indole is sourced from PubChem (CID 22185235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).