6-methoxy-N,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-amine

C15H20N2O — CID 84741634

IUPAC6-methoxy-N,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-amine
SMILESCNC1CCCc2[nH]c3c(C)cc(OC)cc3c21
InChIInChI=1S/C15H20N2O/c1-9-7-10(18-3)8-11-14-12(16-2)5-4-6-13(14)17-15(9)11/h7-8,12,16-17H,4-6H2,1-3H3
InChIKeyHTCRAQIBFYSUQK-UHFFFAOYSA-N
MW244.34 g/mol
LogP3.08
Rot. Bonds2

About 6-methoxy-N,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-amine

6-methoxy-N,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-amine (PubChem CID 84741634) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 6-methoxy-N,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-amine.

Molecular Properties

Compound Name6-methoxy-N,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-amine
PubChem CID84741634
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name6-methoxy-N,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-amine
SMILESCNC1CCCc2[nH]c3c(C)cc(OC)cc3c21
InChIInChI=1S/C15H20N2O/c1-9-7-10(18-3)8-11-14-12(16-2)5-4-6-13(14)17-15(9)11/h7-8,12,16-17H,4-6H2,1-3H3
InChIKeyHTCRAQIBFYSUQK-UHFFFAOYSA-N
XLogP3.08
TPSA37.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-amine?
The IUPAC name of 6-methoxy-N,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-amine (CID 84741634) is 6-methoxy-N,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-amine.
What is the SMILES notation for 6-methoxy-N,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-amine?
The canonical SMILES for 6-methoxy-N,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-amine is CNC1CCCc2[nH]c3c(C)cc(OC)cc3c21.
What is the InChIKey of 6-methoxy-N,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-amine?
The InChIKey is HTCRAQIBFYSUQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-9-7-10(18-3)8-11-14-12(16-2)5-4-6-13(14)17-15(9)11/h7-8,12,16-17H,4-6H2,1-3H3.
What are the key properties of 6-methoxy-N,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-amine?
6-methoxy-N,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-amine has a molecular weight of 244.34 g/mol, XLogP of 3.08, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-amine is sourced from PubChem (CID 84741634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).