7-chloro-9H-pyrido[3,4-b]indole

C11H7ClN2 — CID 22185281

IUPAC7-chloro-9H-pyrido[3,4-b]indole
SMILESClc1ccc2c(c1)[nH]c1cnccc12
InChIInChI=1S/C11H7ClN2/c12-7-1-2-8-9-3-4-13-6-11(9)14-10(8)5-7/h1-6,14H
InChIKeyMQEOFUKOSJJCPH-UHFFFAOYSA-N
MW202.64 g/mol
LogP3.37
Rot. Bonds

About 7-chloro-9H-pyrido[3,4-b]indole

7-chloro-9H-pyrido[3,4-b]indole (PubChem CID 22185281) has the molecular formula C11H7ClN2 and a molecular weight of 202.64 g/mol. Its IUPAC name is 7-chloro-9H-pyrido[3,4-b]indole.

Molecular Properties

Compound Name7-chloro-9H-pyrido[3,4-b]indole
PubChem CID22185281
Molecular FormulaC11H7ClN2
Molecular Weight202.64 g/mol
Exact Mass202.03
IUPAC Name7-chloro-9H-pyrido[3,4-b]indole
SMILESClc1ccc2c(c1)[nH]c1cnccc12
InChIInChI=1S/C11H7ClN2/c12-7-1-2-8-9-3-4-13-6-11(9)14-10(8)5-7/h1-6,14H
InChIKeyMQEOFUKOSJJCPH-UHFFFAOYSA-N
XLogP3.37
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.64
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

8-chloro-5H-benzo[c][1,7]naphthyridin-6-one
CID 134324107
7-(9H-pyrido[3,4-b]indol-7-yloxy)-9H-pyrido[3,4-b]indole
CID 135314461
9H-pyrido[3,4-b]indole-7-carbonitrile
CID 22185223
7-chloro-9H-pyrido[3,4-b]indol-3-amine
CID 115030362
11-chloro-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 122446298
6-chloro-9H-pyrido[3,4-b]indol-8-amine;dihydrochloride
CID 68524321
6-chloro-7-ethoxy-9H-pyrido[3,4-b]indole
CID 141129553
2-chloro-3-iodo-1H-pyrrolo[2,3-c]pyridine
CID 175128278
2-(6-chloro-1H-indazol-3-yl)-3H-imidazo[4,5-c]pyridine
CID 135820027
7-chloro-1,2,3,4-tetradeuterio-9H-carbazole
CID 170651952
6-phenyl-9H-pyrido[3,4-b]indole
CID 122607643
9H-pyrido[3,4-b]indole-6-carbaldehyde
CID 18671949

Frequently Asked Questions

What is the IUPAC name of 7-chloro-9H-pyrido[3,4-b]indole?
The IUPAC name of 7-chloro-9H-pyrido[3,4-b]indole (CID 22185281) is 7-chloro-9H-pyrido[3,4-b]indole.
What is the SMILES notation for 7-chloro-9H-pyrido[3,4-b]indole?
The canonical SMILES for 7-chloro-9H-pyrido[3,4-b]indole is Clc1ccc2c(c1)[nH]c1cnccc12.
What is the InChIKey of 7-chloro-9H-pyrido[3,4-b]indole?
The InChIKey is MQEOFUKOSJJCPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClN2/c12-7-1-2-8-9-3-4-13-6-11(9)14-10(8)5-7/h1-6,14H.
What are the key properties of 7-chloro-9H-pyrido[3,4-b]indole?
7-chloro-9H-pyrido[3,4-b]indole has a molecular weight of 202.64 g/mol, XLogP of 3.37, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-9H-pyrido[3,4-b]indole is sourced from PubChem (CID 22185281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).