6-methoxy-N,N-dimethyl-1,3,4,5-tetrahydrobenzo[cd]indol-4-amine

C14H18N2O — CID 13356524

IUPAC6-methoxy-N,N-dimethyl-1,3,4,5-tetrahydrobenzo[cd]indol-4-amine
SMILESCOc1ccc2[nH]cc3c2c1CC(N(C)C)C3
InChIInChI=1S/C14H18N2O/c1-16(2)10-6-9-8-15-12-4-5-13(17-3)11(7-10)14(9)12/h4-5,8,10,15H,6-7H2,1-3H3
InChIKeyZHSVGDFOQZTIEK-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.21
Rot. Bonds2

About 6-methoxy-N,N-dimethyl-1,3,4,5-tetrahydrobenzo[cd]indol-4-amine

6-methoxy-N,N-dimethyl-1,3,4,5-tetrahydrobenzo[cd]indol-4-amine (PubChem CID 13356524) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 6-methoxy-N,N-dimethyl-1,3,4,5-tetrahydrobenzo[cd]indol-4-amine.

Molecular Properties

Compound Name6-methoxy-N,N-dimethyl-1,3,4,5-tetrahydrobenzo[cd]indol-4-amine
PubChem CID13356524
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name6-methoxy-N,N-dimethyl-1,3,4,5-tetrahydrobenzo[cd]indol-4-amine
SMILESCOc1ccc2[nH]cc3c2c1CC(N(C)C)C3
InChIInChI=1S/C14H18N2O/c1-16(2)10-6-9-8-15-12-4-5-13(17-3)11(7-10)14(9)12/h4-5,8,10,15H,6-7H2,1-3H3
InChIKeyZHSVGDFOQZTIEK-UHFFFAOYSA-N
XLogP2.21
TPSA28.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-methoxy-N,N-dimethyl-1,3,4,5-tetrahydrobenzo[cd]indol-4-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N,N-dimethyl-1,3,4,5-tetrahydrobenzo[cd]indol-4-amine?
The IUPAC name of 6-methoxy-N,N-dimethyl-1,3,4,5-tetrahydrobenzo[cd]indol-4-amine (CID 13356524) is 6-methoxy-N,N-dimethyl-1,3,4,5-tetrahydrobenzo[cd]indol-4-amine.
What is the SMILES notation for 6-methoxy-N,N-dimethyl-1,3,4,5-tetrahydrobenzo[cd]indol-4-amine?
The canonical SMILES for 6-methoxy-N,N-dimethyl-1,3,4,5-tetrahydrobenzo[cd]indol-4-amine is COc1ccc2[nH]cc3c2c1CC(N(C)C)C3.
What is the InChIKey of 6-methoxy-N,N-dimethyl-1,3,4,5-tetrahydrobenzo[cd]indol-4-amine?
The InChIKey is ZHSVGDFOQZTIEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-16(2)10-6-9-8-15-12-4-5-13(17-3)11(7-10)14(9)12/h4-5,8,10,15H,6-7H2,1-3H3.
What are the key properties of 6-methoxy-N,N-dimethyl-1,3,4,5-tetrahydrobenzo[cd]indol-4-amine?
6-methoxy-N,N-dimethyl-1,3,4,5-tetrahydrobenzo[cd]indol-4-amine has a molecular weight of 230.31 g/mol, XLogP of 2.21, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N,N-dimethyl-1,3,4,5-tetrahydrobenzo[cd]indol-4-amine is sourced from PubChem (CID 13356524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).