5H-pyrido[2,3-b]indol-4-amine

C11H9N3 — CID 86754514

IUPAC5H-pyrido[2,3-b]indol-4-amine
SMILESNc1ccnc2c1=C1CC=CC=C1N=2
InChIInChI=1S/C11H9N3/c12-8-5-6-13-11-10(8)7-3-1-2-4-9(7)14-11/h1-2,4-6H,3,12H2
InChIKeyHFMDMKZEHUIXRO-UHFFFAOYSA-N
MW183.21 g/mol
LogP0.29
Rot. Bonds

About 5H-pyrido[2,3-b]indol-4-amine

5H-pyrido[2,3-b]indol-4-amine (PubChem CID 86754514) has the molecular formula C11H9N3 and a molecular weight of 183.21 g/mol. Its IUPAC name is 5H-pyrido[2,3-b]indol-4-amine.

Molecular Properties

Compound Name5H-pyrido[2,3-b]indol-4-amine
PubChem CID86754514
Molecular FormulaC11H9N3
Molecular Weight183.21 g/mol
Exact Mass183.08
IUPAC Name5H-pyrido[2,3-b]indol-4-amine
SMILESNc1ccnc2c1=C1CC=CC=C1N=2
InChIInChI=1S/C11H9N3/c12-8-5-6-13-11-10(8)7-3-1-2-4-9(7)14-11/h1-2,4-6H,3,12H2
InChIKeyHFMDMKZEHUIXRO-UHFFFAOYSA-N
XLogP0.29
TPSA51.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5H-pyrido[2,3-b]indol-4-amine?
The IUPAC name of 5H-pyrido[2,3-b]indol-4-amine (CID 86754514) is 5H-pyrido[2,3-b]indol-4-amine.
What is the SMILES notation for 5H-pyrido[2,3-b]indol-4-amine?
The canonical SMILES for 5H-pyrido[2,3-b]indol-4-amine is Nc1ccnc2c1=C1CC=CC=C1N=2.
What is the InChIKey of 5H-pyrido[2,3-b]indol-4-amine?
The InChIKey is HFMDMKZEHUIXRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3/c12-8-5-6-13-11-10(8)7-3-1-2-4-9(7)14-11/h1-2,4-6H,3,12H2.
What are the key properties of 5H-pyrido[2,3-b]indol-4-amine?
5H-pyrido[2,3-b]indol-4-amine has a molecular weight of 183.21 g/mol, XLogP of 0.29, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5H-pyrido[2,3-b]indol-4-amine is sourced from PubChem (CID 86754514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).