7-methoxy-N-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)quinolin-2-amine

C22H24N2O2 — CID 166382913

IUPAC7-methoxy-N-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)quinolin-2-amine
SMILESCOc1ccc2c(c1)CC(Nc1ccc3ccc(OC)cc3n1)CCC2
InChIInChI=1S/C22H24N2O2/c1-25-19-9-6-15-4-3-5-18(12-17(15)13-19)23-22-11-8-16-7-10-20(26-2)14-21(16)24-22/h6-11,13-14,18H,3-5,12H2,1-2H3,(H,23,24)
InChIKeyAHXLJDZQMTVVSD-UHFFFAOYSA-N
MW348.45 g/mol
LogP4.61
Rot. Bonds4

About 7-methoxy-N-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)quinolin-2-amine

7-methoxy-N-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)quinolin-2-amine (PubChem CID 166382913) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is 7-methoxy-N-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)quinolin-2-amine.

Molecular Properties

Compound Name7-methoxy-N-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)quinolin-2-amine
PubChem CID166382913
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC Name7-methoxy-N-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)quinolin-2-amine
SMILESCOc1ccc2c(c1)CC(Nc1ccc3ccc(OC)cc3n1)CCC2
InChIInChI=1S/C22H24N2O2/c1-25-19-9-6-15-4-3-5-18(12-17(15)13-19)23-22-11-8-16-7-10-20(26-2)14-21(16)24-22/h6-11,13-14,18H,3-5,12H2,1-2H3,(H,23,24)
InChIKeyAHXLJDZQMTVVSD-UHFFFAOYSA-N
XLogP4.61
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 7-methoxy-N-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)quinolin-2-amine 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

6-(4-methoxyphenyl)-N-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)pyrimidin-4-amine
CID 166382927
4-N-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)-2-N,6-dimethylpyrimidine-2,4-diamine
CID 166382908
2-(cyclopropylmethyl)-N-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)-6-methylpyrimidin-4-amine
CID 166382888
7-methoxy-N-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 115510216
N-(2,6-dibromophenyl)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine
CID 107597292
5-ethyl-N-(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)-1,3,4-thiadiazol-2-amine
CID 107647860
2-(4-fluorosulfonyloxyanilino)-7-methoxy-1,2,3,4-tetrahydronaphthalene
CID 146097580
(2R)-5-methoxy-N-methyl-2,3-dihydro-1H-inden-2-amine
CID 86334379
N-(1,2,3,4-tetrahydronaphthalen-2-yl)quinolin-2-amine
CID 60631928
N'-(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)ethane-1,2-diamine
CID 115510402
7-methoxy-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 10082172
7-methoxy-N-(3-methylbutan-2-yl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 115510335

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)quinolin-2-amine?
The IUPAC name of 7-methoxy-N-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)quinolin-2-amine (CID 166382913) is 7-methoxy-N-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)quinolin-2-amine.
What is the SMILES notation for 7-methoxy-N-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)quinolin-2-amine?
The canonical SMILES for 7-methoxy-N-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)quinolin-2-amine is COc1ccc2c(c1)CC(Nc1ccc3ccc(OC)cc3n1)CCC2.
What is the InChIKey of 7-methoxy-N-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)quinolin-2-amine?
The InChIKey is AHXLJDZQMTVVSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O2/c1-25-19-9-6-15-4-3-5-18(12-17(15)13-19)23-22-11-8-16-7-10-20(26-2)14-21(16)24-22/h6-11,13-14,18H,3-5,12H2,1-2H3,(H,23,24).
What are the key properties of 7-methoxy-N-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)quinolin-2-amine?
7-methoxy-N-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)quinolin-2-amine has a molecular weight of 348.45 g/mol, XLogP of 4.61, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)quinolin-2-amine is sourced from PubChem (CID 166382913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).