6-fluoro-9H-pyrido[3,4-b]indol-3-amine

C11H8FN3 — CID 115022160

IUPAC6-fluoro-9H-pyrido[3,4-b]indol-3-amine
SMILESNc1cc2c(cn1)[nH]c1ccc(F)cc12
InChIInChI=1S/C11H8FN3/c12-6-1-2-9-7(3-6)8-4-11(13)14-5-10(8)15-9/h1-5,15H,(H2,13,14)
InChIKeyUEAUZDNDKUXLGO-UHFFFAOYSA-N
MW201.20 g/mol
LogP2.44
Rot. Bonds

About 6-fluoro-9H-pyrido[3,4-b]indol-3-amine

6-fluoro-9H-pyrido[3,4-b]indol-3-amine (PubChem CID 115022160) has the molecular formula C11H8FN3 and a molecular weight of 201.20 g/mol. Its IUPAC name is 6-fluoro-9H-pyrido[3,4-b]indol-3-amine.

Molecular Properties

Compound Name6-fluoro-9H-pyrido[3,4-b]indol-3-amine
PubChem CID115022160
Molecular FormulaC11H8FN3
Molecular Weight201.20 g/mol
Exact Mass201.07
IUPAC Name6-fluoro-9H-pyrido[3,4-b]indol-3-amine
SMILESNc1cc2c(cn1)[nH]c1ccc(F)cc12
InChIInChI=1S/C11H8FN3/c12-6-1-2-9-7(3-6)8-4-11(13)14-5-10(8)15-9/h1-5,15H,(H2,13,14)
InChIKeyUEAUZDNDKUXLGO-UHFFFAOYSA-N
XLogP2.44
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.20
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-methyl-9H-pyrido[3,4-b]indol-3-amine
CID 115021046
3-amino-9H-pyrido[3,4-b]indole-6-carbaldehyde
CID 23559431
7-bromo-9H-pyrido[3,4-b]indol-3-amine
CID 115048933
7-chloro-9H-pyrido[3,4-b]indol-3-amine
CID 115030362
methyl 6-fluoro-9H-pyrido[3,4-b]indole-3-carboxylate
CID 6918825
propyl 6-fluoro-9H-pyrido[3,4-b]indole-3-carboxylate
CID 10333417
12-[4-(trifluoromethyl)phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-4-amine
CID 70942381
6-fluoro-9H-carbazol-2-ol
CID 162369909
3-fluoro-6-methoxy-9H-carbazole
CID 171714917
5-(4-fluorophenyl)pyridin-2-amine
CID 22504802
5,8-difluoroisoquinolin-3-amine
CID 53418204
5-(6-fluoro-9H-pyrido[3,4-b]indol-1-yl)-1,3-thiazole
CID 175168061

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-9H-pyrido[3,4-b]indol-3-amine?
The IUPAC name of 6-fluoro-9H-pyrido[3,4-b]indol-3-amine (CID 115022160) is 6-fluoro-9H-pyrido[3,4-b]indol-3-amine.
What is the SMILES notation for 6-fluoro-9H-pyrido[3,4-b]indol-3-amine?
The canonical SMILES for 6-fluoro-9H-pyrido[3,4-b]indol-3-amine is Nc1cc2c(cn1)[nH]c1ccc(F)cc12.
What is the InChIKey of 6-fluoro-9H-pyrido[3,4-b]indol-3-amine?
The InChIKey is UEAUZDNDKUXLGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8FN3/c12-6-1-2-9-7(3-6)8-4-11(13)14-5-10(8)15-9/h1-5,15H,(H2,13,14).
What are the key properties of 6-fluoro-9H-pyrido[3,4-b]indol-3-amine?
6-fluoro-9H-pyrido[3,4-b]indol-3-amine has a molecular weight of 201.20 g/mol, XLogP of 2.44, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-9H-pyrido[3,4-b]indol-3-amine is sourced from PubChem (CID 115022160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).