7-benzyl-5-methoxyindolo[2,3-c]quinolin-6-one

C23H18N2O2 — CID 122401287

IUPAC7-benzyl-5-methoxyindolo[2,3-c]quinolin-6-one
SMILESCOn1c(=O)c2c(c3ccccc31)c1ccccc1n2Cc1ccccc1
InChIInChI=1S/C23H18N2O2/c1-27-25-20-14-8-6-12-18(20)21-17-11-5-7-13-19(17)24(22(21)23(25)26)15-16-9-3-2-4-10-16/h2-14H,15H2,1H3
InChIKeyRVMCZVWXTBZJFC-UHFFFAOYSA-N
MW354.41 g/mol
LogP4.22
Rot. Bonds3

About 7-benzyl-5-methoxyindolo[2,3-c]quinolin-6-one

7-benzyl-5-methoxyindolo[2,3-c]quinolin-6-one (PubChem CID 122401287) has the molecular formula C23H18N2O2 and a molecular weight of 354.41 g/mol. Its IUPAC name is 7-benzyl-5-methoxyindolo[2,3-c]quinolin-6-one.

Molecular Properties

Compound Name7-benzyl-5-methoxyindolo[2,3-c]quinolin-6-one
PubChem CID122401287
Molecular FormulaC23H18N2O2
Molecular Weight354.41 g/mol
Exact Mass354.14
IUPAC Name7-benzyl-5-methoxyindolo[2,3-c]quinolin-6-one
SMILESCOn1c(=O)c2c(c3ccccc31)c1ccccc1n2Cc1ccccc1
InChIInChI=1S/C23H18N2O2/c1-27-25-20-14-8-6-12-18(20)21-17-11-5-7-13-19(17)24(22(21)23(25)26)15-16-9-3-2-4-10-16/h2-14H,15H2,1H3
InChIKeyRVMCZVWXTBZJFC-UHFFFAOYSA-N
XLogP4.22
TPSA36.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-benzyl-10-methylphenanthridin-6-one
CID 71505961
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10-chloro-5-methoxy-7-methylindolo[2,3-c]quinolin-6-one
CID 122401286
methyl 2-(3-benzyl-2,4-dioxoquinazolin-1-yl)acetate
CID 154831058
9-benzyl-25-ethyl-9,25-diazaoctacyclo[15.15.0.02,10.03,8.011,16.018,23.024,32.026,31]dotriaconta-1(17),2(10),3,5,7,11,13,15,18,20,22,24(32),26,28,30-pentadecaene
CID 118667433
10-benzyl-3-methoxyacridin-9-one
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1-(5-benzylindolo[3,2-b]indol-10-yl)ethanone
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6-benzyl-[1]benzofuro[2,3-b]indole
CID 102518263
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CID 53026427
1-benzyl-3,1-benzoxazine-2,4-dione
CID 520756
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CID 54706810

Frequently Asked Questions

What is the IUPAC name of 7-benzyl-5-methoxyindolo[2,3-c]quinolin-6-one?
The IUPAC name of 7-benzyl-5-methoxyindolo[2,3-c]quinolin-6-one (CID 122401287) is 7-benzyl-5-methoxyindolo[2,3-c]quinolin-6-one.
What is the SMILES notation for 7-benzyl-5-methoxyindolo[2,3-c]quinolin-6-one?
The canonical SMILES for 7-benzyl-5-methoxyindolo[2,3-c]quinolin-6-one is COn1c(=O)c2c(c3ccccc31)c1ccccc1n2Cc1ccccc1.
What is the InChIKey of 7-benzyl-5-methoxyindolo[2,3-c]quinolin-6-one?
The InChIKey is RVMCZVWXTBZJFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2O2/c1-27-25-20-14-8-6-12-18(20)21-17-11-5-7-13-19(17)24(22(21)23(25)26)15-16-9-3-2-4-10-16/h2-14H,15H2,1H3.
What are the key properties of 7-benzyl-5-methoxyindolo[2,3-c]quinolin-6-one?
7-benzyl-5-methoxyindolo[2,3-c]quinolin-6-one has a molecular weight of 354.41 g/mol, XLogP of 4.22, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-benzyl-5-methoxyindolo[2,3-c]quinolin-6-one is sourced from PubChem (CID 122401287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).