9-methoxy-1-methyl-1,2,3,4-tetrahydropyrido[3,4-b]indole

C13H16N2O — CID 13481645

IUPAC9-methoxy-1-methyl-1,2,3,4-tetrahydropyrido[3,4-b]indole
SMILESCOn1c2c(c3ccccc31)CCNC2C
InChIInChI=1S/C13H16N2O/c1-9-13-11(7-8-14-9)10-5-3-4-6-12(10)15(13)16-2/h3-6,9,14H,7-8H2,1-2H3
InChIKeyGYNAFKXLHRMQAX-UHFFFAOYSA-N
MW216.28 g/mol
LogP1.91
Rot. Bonds1

About 9-methoxy-1-methyl-1,2,3,4-tetrahydropyrido[3,4-b]indole

9-methoxy-1-methyl-1,2,3,4-tetrahydropyrido[3,4-b]indole (PubChem CID 13481645) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is 9-methoxy-1-methyl-1,2,3,4-tetrahydropyrido[3,4-b]indole.

Molecular Properties

Compound Name9-methoxy-1-methyl-1,2,3,4-tetrahydropyrido[3,4-b]indole
PubChem CID13481645
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC Name9-methoxy-1-methyl-1,2,3,4-tetrahydropyrido[3,4-b]indole
SMILESCOn1c2c(c3ccccc31)CCNC2C
InChIInChI=1S/C13H16N2O/c1-9-13-11(7-8-14-9)10-5-3-4-6-12(10)15(13)16-2/h3-6,9,14H,7-8H2,1-2H3
InChIKeyGYNAFKXLHRMQAX-UHFFFAOYSA-N
XLogP1.91
TPSA26.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 9-methoxy-1-methyl-1,2,3,4-tetrahydropyrido[3,4-b]indole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9-benzyl-1-methyl-1,2,3,4-tetrahydropyrido[3,4-b]indole
CID 91115191
1,3,6-triazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10,12,14-tetraen-2-one
CID 20513183
9-(methoxymethyl)-1-prop-2-enyl-1,2,3,4-tetrahydropyrido[3,4-b]indole
CID 14845123
2,6-dimethyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]indole
CID 170405716
1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole;hydrochloride
CID 6419924
6-chloro-5-methyl-1,2,3,5-tetrahydroazepino[4,5-b]indol-4-one
CID 70098889
1,11-dimethyl-2,3,4,5-tetrahydro-1H-[1,4]diazepino[1,2-a]indole
CID 71370609
1-benzyl-1,2,3,4-tetrahydropyrido[3,4-b]indole-9-carboxylic acid
CID 90752239
1,1,9-trimethyl-3,4-dihydro-2H-pyrido[3,4-b]indole
CID 82393965
6-fluoro-5-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline
CID 83377554
16-methyl-4,6,16-triazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),10,12,14-tetraen-5-one
CID 72724645
4-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]indole
CID 82411813

Frequently Asked Questions

What is the IUPAC name of 9-methoxy-1-methyl-1,2,3,4-tetrahydropyrido[3,4-b]indole?
The IUPAC name of 9-methoxy-1-methyl-1,2,3,4-tetrahydropyrido[3,4-b]indole (CID 13481645) is 9-methoxy-1-methyl-1,2,3,4-tetrahydropyrido[3,4-b]indole.
What is the SMILES notation for 9-methoxy-1-methyl-1,2,3,4-tetrahydropyrido[3,4-b]indole?
The canonical SMILES for 9-methoxy-1-methyl-1,2,3,4-tetrahydropyrido[3,4-b]indole is COn1c2c(c3ccccc31)CCNC2C.
What is the InChIKey of 9-methoxy-1-methyl-1,2,3,4-tetrahydropyrido[3,4-b]indole?
The InChIKey is GYNAFKXLHRMQAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-9-13-11(7-8-14-9)10-5-3-4-6-12(10)15(13)16-2/h3-6,9,14H,7-8H2,1-2H3.
What are the key properties of 9-methoxy-1-methyl-1,2,3,4-tetrahydropyrido[3,4-b]indole?
9-methoxy-1-methyl-1,2,3,4-tetrahydropyrido[3,4-b]indole has a molecular weight of 216.28 g/mol, XLogP of 1.91, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methoxy-1-methyl-1,2,3,4-tetrahydropyrido[3,4-b]indole is sourced from PubChem (CID 13481645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).