6-chloro-9H-(214C)pyridino[3,4-b]indol-8-amine

C11H8ClN3 — CID 11435942

IUPAC6-chloro-9H-(214C)pyridino[3,4-b]indol-8-amine
SMILESNc1cc(Cl)cc2c1[nH]c1[14cH]nccc12
InChIInChI=1S/C11H8ClN3/c12-6-3-8-7-1-2-14-5-10(7)15-11(8)9(13)4-6/h1-5,15H,13H2/i5+2
InChIKeyHHZQETZZACUFHE-RHRFEJLCSA-N
MW219.65 g/mol
LogP2.95
Rot. Bonds

About 6-chloro-9H-(214C)pyridino[3,4-b]indol-8-amine

6-chloro-9H-(214C)pyridino[3,4-b]indol-8-amine (PubChem CID 11435942) has the molecular formula C11H8ClN3 and a molecular weight of 219.65 g/mol. Its IUPAC name is 6-chloro-9H-(214C)pyridino[3,4-b]indol-8-amine.

Molecular Properties

Compound Name6-chloro-9H-(214C)pyridino[3,4-b]indol-8-amine
PubChem CID11435942
Molecular FormulaC11H8ClN3
Molecular Weight219.65 g/mol
Exact Mass219.04
IUPAC Name6-chloro-9H-(214C)pyridino[3,4-b]indol-8-amine
SMILESNc1cc(Cl)cc2c1[nH]c1[14cH]nccc12
InChIInChI=1S/C11H8ClN3/c12-6-3-8-7-1-2-14-5-10(7)15-11(8)9(13)4-6/h1-5,15H,13H2/i5+2
InChIKeyHHZQETZZACUFHE-RHRFEJLCSA-N
XLogP2.95
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.65
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

6-chloro-9H-pyrido[3,4-b]indol-8-amine;dihydrochloride
CID 68524321
6,8-dichloroquinolin-4-amine
CID 16767412
6-chloro-4-fluoro-9H-pyrido[3,4-b]indol-8-amine
CID 59337538
6-chloro-8-iodoquinolin-4-amine
CID 107628509
6-chloronaphthalene-1,4-diamine
CID 21424529
3,6-dichloro-1,8-diiodo-9H-carbazole
CID 16719908
6-chloro-1-methyl-8-(4-methylphenyl)-9H-pyrido[3,4-b]indole
CID 134483619
(4-amino-6-chloro-1H-benzimidazol-2-yl)methanol
CID 115647651
3,5-dichloro-2-methoxyaniline
CID 11217747
6-chloro-3-iodo-2H-indazol-4-amine
CID 24728283
8-(3,5-dichlorophenoxy)isoquinolin-5-amine
CID 103139890
4-[(5-amino-7-chloroisoquinolin-1-yl)amino]cyclohexan-1-ol
CID 98759676

Frequently Asked Questions

What is the IUPAC name of 6-chloro-9H-(214C)pyridino[3,4-b]indol-8-amine?
The IUPAC name of 6-chloro-9H-(214C)pyridino[3,4-b]indol-8-amine (CID 11435942) is 6-chloro-9H-(214C)pyridino[3,4-b]indol-8-amine.
What is the SMILES notation for 6-chloro-9H-(214C)pyridino[3,4-b]indol-8-amine?
The canonical SMILES for 6-chloro-9H-(214C)pyridino[3,4-b]indol-8-amine is Nc1cc(Cl)cc2c1[nH]c1[14cH]nccc12.
What is the InChIKey of 6-chloro-9H-(214C)pyridino[3,4-b]indol-8-amine?
The InChIKey is HHZQETZZACUFHE-RHRFEJLCSA-N. The full InChI is InChI=1S/C11H8ClN3/c12-6-3-8-7-1-2-14-5-10(7)15-11(8)9(13)4-6/h1-5,15H,13H2/i5+2.
What are the key properties of 6-chloro-9H-(214C)pyridino[3,4-b]indol-8-amine?
6-chloro-9H-(214C)pyridino[3,4-b]indol-8-amine has a molecular weight of 219.65 g/mol, XLogP of 2.95, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-9H-(214C)pyridino[3,4-b]indol-8-amine is sourced from PubChem (CID 11435942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).