11-methyl-12aH-quinolino[2,3-b]quinolin-12-one

C17H12N2O — CID 75297918

IUPAC11-methyl-12aH-quinolino[2,3-b]quinolin-12-one
SMILESCc1c2c(nc3ccccc13)N=C1C=CC=CC1C2=O
InChIInChI=1S/C17H12N2O/c1-10-11-6-2-4-8-13(11)18-17-15(10)16(20)12-7-3-5-9-14(12)19-17/h2-9,12H,1H3
InChIKeyJXPBCEAYZBUIRJ-UHFFFAOYSA-N
MW260.30 g/mol
LogP3.55
Rot. Bonds

About 11-methyl-12aH-quinolino[2,3-b]quinolin-12-one

11-methyl-12aH-quinolino[2,3-b]quinolin-12-one (PubChem CID 75297918) has the molecular formula C17H12N2O and a molecular weight of 260.30 g/mol. Its IUPAC name is 11-methyl-12aH-quinolino[2,3-b]quinolin-12-one.

Molecular Properties

Compound Name11-methyl-12aH-quinolino[2,3-b]quinolin-12-one
PubChem CID75297918
Molecular FormulaC17H12N2O
Molecular Weight260.30 g/mol
Exact Mass260.09
IUPAC Name11-methyl-12aH-quinolino[2,3-b]quinolin-12-one
SMILESCc1c2c(nc3ccccc13)N=C1C=CC=CC1C2=O
InChIInChI=1S/C17H12N2O/c1-10-11-6-2-4-8-13(11)18-17-15(10)16(20)12-7-3-5-9-14(12)19-17/h2-9,12H,1H3
InChIKeyJXPBCEAYZBUIRJ-UHFFFAOYSA-N
XLogP3.55
TPSA42.32 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 72710503
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CID 175084711
7-methylbenzo[b][1,10]phenanthroline-5,6-dione
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ethane;11-methyl-[1]benzofuro[3,2-b]quinoline
CID 143798134
5,6-dimethyl-10aH-indeno[2,1-b]indole
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N,N,4-trimethylquinazolin-2-amine
CID 119091997
1-(2,4-dimethylquinolin-3-yl)-2,2,2-trifluoroethanone
CID 139234339
5-methyl-12-azatetracyclo[9.8.0.03,8.013,18]nonadeca-1(19),3(8),4,6,9,11,13,15,17-nonaen-2-one
CID 102134774
9-methylselenadiazolo[4,5-b]quinoline
CID 11557837
1-(3-hydroxy-4-methylquinolin-2-yl)ethanone
CID 134989412
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CID 59938499

Frequently Asked Questions

What is the IUPAC name of 11-methyl-12aH-quinolino[2,3-b]quinolin-12-one?
The IUPAC name of 11-methyl-12aH-quinolino[2,3-b]quinolin-12-one (CID 75297918) is 11-methyl-12aH-quinolino[2,3-b]quinolin-12-one.
What is the SMILES notation for 11-methyl-12aH-quinolino[2,3-b]quinolin-12-one?
The canonical SMILES for 11-methyl-12aH-quinolino[2,3-b]quinolin-12-one is Cc1c2c(nc3ccccc13)N=C1C=CC=CC1C2=O.
What is the InChIKey of 11-methyl-12aH-quinolino[2,3-b]quinolin-12-one?
The InChIKey is JXPBCEAYZBUIRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2O/c1-10-11-6-2-4-8-13(11)18-17-15(10)16(20)12-7-3-5-9-14(12)19-17/h2-9,12H,1H3.
What are the key properties of 11-methyl-12aH-quinolino[2,3-b]quinolin-12-one?
11-methyl-12aH-quinolino[2,3-b]quinolin-12-one has a molecular weight of 260.30 g/mol, XLogP of 3.55, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 11-methyl-12aH-quinolino[2,3-b]quinolin-12-one is sourced from PubChem (CID 75297918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).