7-fluoro-N-methyl-2,3,4,9-tetrahydro-1H-carbazol-2-amine

C13H15FN2 — CID 84622882

IUPAC7-fluoro-N-methyl-2,3,4,9-tetrahydro-1H-carbazol-2-amine
SMILESCNC1CCc2c([nH]c3cc(F)ccc23)C1
InChIInChI=1S/C13H15FN2/c1-15-9-3-5-11-10-4-2-8(14)6-12(10)16-13(11)7-9/h2,4,6,9,15-16H,3,5,7H2,1H3
InChIKeyHOXLIIYNQFUHBU-UHFFFAOYSA-N
MW218.28 g/mol
LogP2.38
Rot. Bonds1

About 7-fluoro-N-methyl-2,3,4,9-tetrahydro-1H-carbazol-2-amine

7-fluoro-N-methyl-2,3,4,9-tetrahydro-1H-carbazol-2-amine (PubChem CID 84622882) has the molecular formula C13H15FN2 and a molecular weight of 218.28 g/mol. Its IUPAC name is 7-fluoro-N-methyl-2,3,4,9-tetrahydro-1H-carbazol-2-amine.

Molecular Properties

Compound Name7-fluoro-N-methyl-2,3,4,9-tetrahydro-1H-carbazol-2-amine
PubChem CID84622882
Molecular FormulaC13H15FN2
Molecular Weight218.28 g/mol
Exact Mass218.12
IUPAC Name7-fluoro-N-methyl-2,3,4,9-tetrahydro-1H-carbazol-2-amine
SMILESCNC1CCc2c([nH]c3cc(F)ccc23)C1
InChIInChI=1S/C13H15FN2/c1-15-9-3-5-11-10-4-2-8(14)6-12(10)16-13(11)7-9/h2,4,6,9,15-16H,3,5,7H2,1H3
InChIKeyHOXLIIYNQFUHBU-UHFFFAOYSA-N
XLogP2.38
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.28
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

1-(7-fluoro-2,3,4,9-tetrahydro-1H-carbazol-3-yl)-N-methylmethanamine
CID 84626995
4-fluoro-N-(7-fluoro-2,3,4,9-tetrahydro-1H-carbazol-3-yl)benzamide
CID 113097133
8-fluoro-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole
CID 22396704
7-chloro-6-methoxy-N-methyl-2,3,4,9-tetrahydro-1H-carbazol-2-amine
CID 84639757
ethyl N-(7-fluoro-2,3,4,9-tetrahydro-1H-carbazol-3-yl)carbamate
CID 113097176
(2R)-6-fluoro-2,3,4,9-tetrahydro-1H-carbazol-2-amine
CID 86330440
2-(4-fluorophenyl)-N-(2,3,4,9-tetrahydro-1H-carbazol-2-yl)acetamide
CID 84580171
7-fluoro-N-methyl-1,2,3,4-tetrahydrocyclopenta[b]indol-1-amine
CID 65332914
N-(7-fluoro-2,3,4,9-tetrahydro-1H-carbazol-3-yl)-2-(4-methoxyphenyl)acetamide
CID 113097150
1-(7-fluoro-2,3,4,9-tetrahydro-1H-carbazol-4-yl)-N-methylmethanamine
CID 84740967
N-(7-fluoro-2,3,4,9-tetrahydro-1H-carbazol-3-yl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 113097212
N-(7-fluoro-2,3,4,9-tetrahydro-1H-carbazol-3-yl)furan-2-carboxamide
CID 113097125

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-N-methyl-2,3,4,9-tetrahydro-1H-carbazol-2-amine?
The IUPAC name of 7-fluoro-N-methyl-2,3,4,9-tetrahydro-1H-carbazol-2-amine (CID 84622882) is 7-fluoro-N-methyl-2,3,4,9-tetrahydro-1H-carbazol-2-amine.
What is the SMILES notation for 7-fluoro-N-methyl-2,3,4,9-tetrahydro-1H-carbazol-2-amine?
The canonical SMILES for 7-fluoro-N-methyl-2,3,4,9-tetrahydro-1H-carbazol-2-amine is CNC1CCc2c([nH]c3cc(F)ccc23)C1.
What is the InChIKey of 7-fluoro-N-methyl-2,3,4,9-tetrahydro-1H-carbazol-2-amine?
The InChIKey is HOXLIIYNQFUHBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FN2/c1-15-9-3-5-11-10-4-2-8(14)6-12(10)16-13(11)7-9/h2,4,6,9,15-16H,3,5,7H2,1H3.
What are the key properties of 7-fluoro-N-methyl-2,3,4,9-tetrahydro-1H-carbazol-2-amine?
7-fluoro-N-methyl-2,3,4,9-tetrahydro-1H-carbazol-2-amine has a molecular weight of 218.28 g/mol, XLogP of 2.38, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-N-methyl-2,3,4,9-tetrahydro-1H-carbazol-2-amine is sourced from PubChem (CID 84622882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).