6-ethylpyrido[2,3-b]indol-9-amine

C13H13N3 — CID 91225284

IUPAC6-ethylpyrido[2,3-b]indol-9-amine
SMILESCCc1ccc2c(c1)c1cccnc1n2N
InChIInChI=1S/C13H13N3/c1-2-9-5-6-12-11(8-9)10-4-3-7-15-13(10)16(12)14/h3-8H,2,14H2,1H3
InChIKeyZPLWCZWVBPDCNA-UHFFFAOYSA-N
MW211.27 g/mol
LogP2.47
Rot. Bonds1

About 6-ethylpyrido[2,3-b]indol-9-amine

6-ethylpyrido[2,3-b]indol-9-amine (PubChem CID 91225284) has the molecular formula C13H13N3 and a molecular weight of 211.27 g/mol. Its IUPAC name is 6-ethylpyrido[2,3-b]indol-9-amine.

Molecular Properties

Compound Name6-ethylpyrido[2,3-b]indol-9-amine
PubChem CID91225284
Molecular FormulaC13H13N3
Molecular Weight211.27 g/mol
Exact Mass211.11
IUPAC Name6-ethylpyrido[2,3-b]indol-9-amine
SMILESCCc1ccc2c(c1)c1cccnc1n2N
InChIInChI=1S/C13H13N3/c1-2-9-5-6-12-11(8-9)10-4-3-7-15-13(10)16(12)14/h3-8H,2,14H2,1H3
InChIKeyZPLWCZWVBPDCNA-UHFFFAOYSA-N
XLogP2.47
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.27
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-ethylpyrido[2,3-b]indol-9-amine?
The IUPAC name of 6-ethylpyrido[2,3-b]indol-9-amine (CID 91225284) is 6-ethylpyrido[2,3-b]indol-9-amine.
What is the SMILES notation for 6-ethylpyrido[2,3-b]indol-9-amine?
The canonical SMILES for 6-ethylpyrido[2,3-b]indol-9-amine is CCc1ccc2c(c1)c1cccnc1n2N.
What is the InChIKey of 6-ethylpyrido[2,3-b]indol-9-amine?
The InChIKey is ZPLWCZWVBPDCNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3/c1-2-9-5-6-12-11(8-9)10-4-3-7-15-13(10)16(12)14/h3-8H,2,14H2,1H3.
What are the key properties of 6-ethylpyrido[2,3-b]indol-9-amine?
6-ethylpyrido[2,3-b]indol-9-amine has a molecular weight of 211.27 g/mol, XLogP of 2.47, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethylpyrido[2,3-b]indol-9-amine is sourced from PubChem (CID 91225284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).