2-[9-[2-(dimethylamino)ethoxy]-11-methylindolo[2,3-b]quinolin-6-yl]-N,N-dimethylethanamine

C24H30N4O — CID 70691207

IUPAC2-[9-[2-(dimethylamino)ethoxy]-11-methylindolo[2,3-b]quinolin-6-yl]-N,N-dimethylethanamine
SMILESCc1c2ccccc2nc2c1c1cc(OCCN(C)C)ccc1n2CCN(C)C
InChIInChI=1S/C24H30N4O/c1-17-19-8-6-7-9-21(19)25-24-23(17)20-16-18(29-15-14-27(4)5)10-11-22(20)28(24)13-12-26(2)3/h6-11,16H,12-15H2,1-5H3
InChIKeyBMXLSSJVYHSNCS-UHFFFAOYSA-N
MW390.53 g/mol
LogP4.15
Rot. Bonds7

About 2-[9-[2-(dimethylamino)ethoxy]-11-methylindolo[2,3-b]quinolin-6-yl]-N,N-dimethylethanamine

2-[9-[2-(dimethylamino)ethoxy]-11-methylindolo[2,3-b]quinolin-6-yl]-N,N-dimethylethanamine (PubChem CID 70691207) has the molecular formula C24H30N4O and a molecular weight of 390.53 g/mol. Its IUPAC name is 2-[9-[2-(dimethylamino)ethoxy]-11-methylindolo[2,3-b]quinolin-6-yl]-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-[9-[2-(dimethylamino)ethoxy]-11-methylindolo[2,3-b]quinolin-6-yl]-N,N-dimethylethanamine
PubChem CID70691207
Molecular FormulaC24H30N4O
Molecular Weight390.53 g/mol
Exact Mass390.24
IUPAC Name2-[9-[2-(dimethylamino)ethoxy]-11-methylindolo[2,3-b]quinolin-6-yl]-N,N-dimethylethanamine
SMILESCc1c2ccccc2nc2c1c1cc(OCCN(C)C)ccc1n2CCN(C)C
InChIInChI=1S/C24H30N4O/c1-17-19-8-6-7-9-21(19)25-24-23(17)20-16-18(29-15-14-27(4)5)10-11-22(20)28(24)13-12-26(2)3/h6-11,16H,12-15H2,1-5H3
InChIKeyBMXLSSJVYHSNCS-UHFFFAOYSA-N
XLogP4.15
TPSA33.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.53
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[9-[2-(dimethylamino)ethoxy]-11-methylindolo[2,3-b]quinolin-6-yl]-N,N-dimethylethanamine?
The IUPAC name of 2-[9-[2-(dimethylamino)ethoxy]-11-methylindolo[2,3-b]quinolin-6-yl]-N,N-dimethylethanamine (CID 70691207) is 2-[9-[2-(dimethylamino)ethoxy]-11-methylindolo[2,3-b]quinolin-6-yl]-N,N-dimethylethanamine.
What is the SMILES notation for 2-[9-[2-(dimethylamino)ethoxy]-11-methylindolo[2,3-b]quinolin-6-yl]-N,N-dimethylethanamine?
The canonical SMILES for 2-[9-[2-(dimethylamino)ethoxy]-11-methylindolo[2,3-b]quinolin-6-yl]-N,N-dimethylethanamine is Cc1c2ccccc2nc2c1c1cc(OCCN(C)C)ccc1n2CCN(C)C.
What is the InChIKey of 2-[9-[2-(dimethylamino)ethoxy]-11-methylindolo[2,3-b]quinolin-6-yl]-N,N-dimethylethanamine?
The InChIKey is BMXLSSJVYHSNCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N4O/c1-17-19-8-6-7-9-21(19)25-24-23(17)20-16-18(29-15-14-27(4)5)10-11-22(20)28(24)13-12-26(2)3/h6-11,16H,12-15H2,1-5H3.
What are the key properties of 2-[9-[2-(dimethylamino)ethoxy]-11-methylindolo[2,3-b]quinolin-6-yl]-N,N-dimethylethanamine?
2-[9-[2-(dimethylamino)ethoxy]-11-methylindolo[2,3-b]quinolin-6-yl]-N,N-dimethylethanamine has a molecular weight of 390.53 g/mol, XLogP of 4.15, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[9-[2-(dimethylamino)ethoxy]-11-methylindolo[2,3-b]quinolin-6-yl]-N,N-dimethylethanamine is sourced from PubChem (CID 70691207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).