3-(6-methylquinolin-2-yl)-2-phenylchromen-4-one

C25H17NO2 — CID 164519667

IUPAC3-(6-methylquinolin-2-yl)-2-phenylchromen-4-one
SMILESCc1ccc2nc(-c3c(-c4ccccc4)oc4ccccc4c3=O)ccc2c1
InChIInChI=1S/C25H17NO2/c1-16-11-13-20-18(15-16)12-14-21(26-20)23-24(27)19-9-5-6-10-22(19)28-25(23)17-7-3-2-4-8-17/h2-15H,1H3
InChIKeyQBAQVFOHNNKTFM-UHFFFAOYSA-N
MW363.42 g/mol
LogP5.98
Rot. Bonds2

About 3-(6-methylquinolin-2-yl)-2-phenylchromen-4-one

3-(6-methylquinolin-2-yl)-2-phenylchromen-4-one (PubChem CID 164519667) has the molecular formula C25H17NO2 and a molecular weight of 363.42 g/mol. Its IUPAC name is 3-(6-methylquinolin-2-yl)-2-phenylchromen-4-one.

Molecular Properties

Compound Name3-(6-methylquinolin-2-yl)-2-phenylchromen-4-one
PubChem CID164519667
Molecular FormulaC25H17NO2
Molecular Weight363.42 g/mol
Exact Mass363.13
IUPAC Name3-(6-methylquinolin-2-yl)-2-phenylchromen-4-one
SMILESCc1ccc2nc(-c3c(-c4ccccc4)oc4ccccc4c3=O)ccc2c1
InChIInChI=1S/C25H17NO2/c1-16-11-13-20-18(15-16)12-14-21(26-20)23-24(27)19-9-5-6-10-22(19)28-25(23)17-7-3-2-4-8-17/h2-15H,1H3
InChIKeyQBAQVFOHNNKTFM-UHFFFAOYSA-N
XLogP5.98
TPSA43.10 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.42
LogP ≤ 55.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

7-chloro-2-phenyl-3-quinolin-2-ylchromen-4-one
CID 164519672
3-isoquinolin-3-yl-2-phenylchromen-4-one
CID 175381344
2-(6-methylquinolin-2-yl)-4-phenylquinazoline
CID 162351932
4-[3-(3-methylphenyl)-4-oxochromen-2-yl]benzenesulfonamide
CID 18324999
3-iodo-6-methyl-2-phenylchromen-4-one
CID 164665609
3-methoxy-2-(4-methylphenyl)chromen-4-one
CID 139049420
methanesulfonic acid;3-methyl-2-phenylchromen-4-one
CID 172814371
4-[2-(4-methylphenyl)-1-benzofuran-3-yl]-5-phenyl-2H-triazole
CID 138393037
2-methylxanthen-9-one;xanthen-9-one
CID 70546954
7-methyl-2-phenylchromeno[2,3-b]pyridin-5-one
CID 71384416
3-but-3-en-2-yl-2-phenylchromen-4-one
CID 102136808
2-(3,4-dimethoxyphenyl)-3-phenylchromen-4-one
CID 140540725

Frequently Asked Questions

What is the IUPAC name of 3-(6-methylquinolin-2-yl)-2-phenylchromen-4-one?
The IUPAC name of 3-(6-methylquinolin-2-yl)-2-phenylchromen-4-one (CID 164519667) is 3-(6-methylquinolin-2-yl)-2-phenylchromen-4-one.
What is the SMILES notation for 3-(6-methylquinolin-2-yl)-2-phenylchromen-4-one?
The canonical SMILES for 3-(6-methylquinolin-2-yl)-2-phenylchromen-4-one is Cc1ccc2nc(-c3c(-c4ccccc4)oc4ccccc4c3=O)ccc2c1.
What is the InChIKey of 3-(6-methylquinolin-2-yl)-2-phenylchromen-4-one?
The InChIKey is QBAQVFOHNNKTFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H17NO2/c1-16-11-13-20-18(15-16)12-14-21(26-20)23-24(27)19-9-5-6-10-22(19)28-25(23)17-7-3-2-4-8-17/h2-15H,1H3.
What are the key properties of 3-(6-methylquinolin-2-yl)-2-phenylchromen-4-one?
3-(6-methylquinolin-2-yl)-2-phenylchromen-4-one has a molecular weight of 363.42 g/mol, XLogP of 5.98, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-methylquinolin-2-yl)-2-phenylchromen-4-one is sourced from PubChem (CID 164519667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).