9-ethyl-9H-pyrido[3,2-b]indole

C13H12N2 — CID 142740001

IUPAC9-ethyl-9H-pyrido[3,2-b]indole
SMILESCCC1C=CC=C2N=c3cccnc3=C21
InChIInChI=1S/C13H12N2/c1-2-9-5-3-6-10-12(9)13-11(15-10)7-4-8-14-13/h3-9H,2H2,1H3
InChIKeyHQJXABKXHCTGGX-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.35
Rot. Bonds1

About 9-ethyl-9H-pyrido[3,2-b]indole

9-ethyl-9H-pyrido[3,2-b]indole (PubChem CID 142740001) has the molecular formula C13H12N2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 9-ethyl-9H-pyrido[3,2-b]indole.

Molecular Properties

Compound Name9-ethyl-9H-pyrido[3,2-b]indole
PubChem CID142740001
Molecular FormulaC13H12N2
Molecular Weight196.25 g/mol
Exact Mass196.10
IUPAC Name9-ethyl-9H-pyrido[3,2-b]indole
SMILESCCC1C=CC=C2N=c3cccnc3=C21
InChIInChI=1S/C13H12N2/c1-2-9-5-3-6-10-12(9)13-11(15-10)7-4-8-14-13/h3-9H,2H2,1H3
InChIKeyHQJXABKXHCTGGX-UHFFFAOYSA-N
XLogP1.35
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9H-Pyrido[4,3-b]indole
CID 15897929
1-Methyl-9H-pyrido[4,3-b]indole
CID 15897930
Pyrrolo[2,3-c]carbazole
CID 19960015
Pyrrolo[3,4-c]carbazole
CID 21887285
Azepinoindole
CID 88692169
Dipyrroloquinoline
CID 129695406
Methylazepino indole
CID 129789857
5h-Benzo(e)pyrido-(4,3)-indole
CID 129721092
4,5-Dihydroindenopyridine
CID 129783754
Indolo[4,5-e]indole
CID 129791560
Pyrrolo[4,3,2-de]pyrrolo[2,3-h]quinoline
CID 129827937
Dihydroindolo[4,5-e]indole
CID 129873830

Frequently Asked Questions

What is the IUPAC name of 9-ethyl-9H-pyrido[3,2-b]indole?
The IUPAC name of 9-ethyl-9H-pyrido[3,2-b]indole (CID 142740001) is 9-ethyl-9H-pyrido[3,2-b]indole.
What is the SMILES notation for 9-ethyl-9H-pyrido[3,2-b]indole?
The canonical SMILES for 9-ethyl-9H-pyrido[3,2-b]indole is CCC1C=CC=C2N=c3cccnc3=C21.
What is the InChIKey of 9-ethyl-9H-pyrido[3,2-b]indole?
The InChIKey is HQJXABKXHCTGGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2/c1-2-9-5-3-6-10-12(9)13-11(15-10)7-4-8-14-13/h3-9H,2H2,1H3.
What are the key properties of 9-ethyl-9H-pyrido[3,2-b]indole?
9-ethyl-9H-pyrido[3,2-b]indole has a molecular weight of 196.25 g/mol, XLogP of 1.35, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-9H-pyrido[3,2-b]indole is sourced from PubChem (CID 142740001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).