1-(4-methylphenyl)-8-phenyl-3,4-dihydrofuro[2,3-h]quinolin-2-one

C24H19NO2 — CID 102451914

IUPAC1-(4-methylphenyl)-8-phenyl-3,4-dihydrofuro[2,3-h]quinolin-2-one
SMILESCc1ccc(N2C(=O)CCc3ccc4oc(-c5ccccc5)cc4c32)cc1
InChIInChI=1S/C24H19NO2/c1-16-7-11-19(12-8-16)25-23(26)14-10-18-9-13-21-20(24(18)25)15-22(27-21)17-5-3-2-4-6-17/h2-9,11-13,15H,10,14H2,1H3
InChIKeyRBWCOQISQKVAKV-UHFFFAOYSA-N
MW353.42 g/mol
LogP6.02
Rot. Bonds2

About 1-(4-methylphenyl)-8-phenyl-3,4-dihydrofuro[2,3-h]quinolin-2-one

1-(4-methylphenyl)-8-phenyl-3,4-dihydrofuro[2,3-h]quinolin-2-one (PubChem CID 102451914) has the molecular formula C24H19NO2 and a molecular weight of 353.42 g/mol. Its IUPAC name is 1-(4-methylphenyl)-8-phenyl-3,4-dihydrofuro[2,3-h]quinolin-2-one.

Molecular Properties

Compound Name1-(4-methylphenyl)-8-phenyl-3,4-dihydrofuro[2,3-h]quinolin-2-one
PubChem CID102451914
Molecular FormulaC24H19NO2
Molecular Weight353.42 g/mol
Exact Mass353.14
IUPAC Name1-(4-methylphenyl)-8-phenyl-3,4-dihydrofuro[2,3-h]quinolin-2-one
SMILESCc1ccc(N2C(=O)CCc3ccc4oc(-c5ccccc5)cc4c32)cc1
InChIInChI=1S/C24H19NO2/c1-16-7-11-19(12-8-16)25-23(26)14-10-18-9-13-21-20(24(18)25)15-22(27-21)17-5-3-2-4-6-17/h2-9,11-13,15H,10,14H2,1H3
InChIKeyRBWCOQISQKVAKV-UHFFFAOYSA-N
XLogP6.02
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500353.42
LogP ≤ 56.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methylphenyl)-8-phenyl-3,4-dihydrofuro[2,3-h]quinolin-2-one?
The IUPAC name of 1-(4-methylphenyl)-8-phenyl-3,4-dihydrofuro[2,3-h]quinolin-2-one (CID 102451914) is 1-(4-methylphenyl)-8-phenyl-3,4-dihydrofuro[2,3-h]quinolin-2-one.
What is the SMILES notation for 1-(4-methylphenyl)-8-phenyl-3,4-dihydrofuro[2,3-h]quinolin-2-one?
The canonical SMILES for 1-(4-methylphenyl)-8-phenyl-3,4-dihydrofuro[2,3-h]quinolin-2-one is Cc1ccc(N2C(=O)CCc3ccc4oc(-c5ccccc5)cc4c32)cc1.
What is the InChIKey of 1-(4-methylphenyl)-8-phenyl-3,4-dihydrofuro[2,3-h]quinolin-2-one?
The InChIKey is RBWCOQISQKVAKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19NO2/c1-16-7-11-19(12-8-16)25-23(26)14-10-18-9-13-21-20(24(18)25)15-22(27-21)17-5-3-2-4-6-17/h2-9,11-13,15H,10,14H2,1H3.
What are the key properties of 1-(4-methylphenyl)-8-phenyl-3,4-dihydrofuro[2,3-h]quinolin-2-one?
1-(4-methylphenyl)-8-phenyl-3,4-dihydrofuro[2,3-h]quinolin-2-one has a molecular weight of 353.42 g/mol, XLogP of 6.02, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylphenyl)-8-phenyl-3,4-dihydrofuro[2,3-h]quinolin-2-one is sourced from PubChem (CID 102451914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).