3,9-dimethoxy-5-methyl-[1]benzofuro[3,2-c]quinolin-6-one

C18H15NO4 — CID 2794540

IUPAC3,9-dimethoxy-5-methyl-[1]benzofuro[3,2-c]quinolin-6-one
SMILESCOc1ccc2c(c1)oc1c3ccc(OC)cc3n(C)c(=O)c21
InChIInChI=1S/C18H15NO4/c1-19-14-8-10(21-2)4-6-12(14)17-16(18(19)20)13-7-5-11(22-3)9-15(13)23-17/h4-9H,1-3H3
InChIKeySBEKYZCFCAIVOB-UHFFFAOYSA-N
MW309.32 g/mol
LogP3.46
Rot. Bonds2

About 3,9-dimethoxy-5-methyl-[1]benzofuro[3,2-c]quinolin-6-one

3,9-dimethoxy-5-methyl-[1]benzofuro[3,2-c]quinolin-6-one (PubChem CID 2794540) has the molecular formula C18H15NO4 and a molecular weight of 309.32 g/mol. Its IUPAC name is 3,9-dimethoxy-5-methyl-[1]benzofuro[3,2-c]quinolin-6-one.

Molecular Properties

Compound Name3,9-dimethoxy-5-methyl-[1]benzofuro[3,2-c]quinolin-6-one
PubChem CID2794540
Molecular FormulaC18H15NO4
Molecular Weight309.32 g/mol
Exact Mass309.10
IUPAC Name3,9-dimethoxy-5-methyl-[1]benzofuro[3,2-c]quinolin-6-one
SMILESCOc1ccc2c(c1)oc1c3ccc(OC)cc3n(C)c(=O)c21
InChIInChI=1S/C18H15NO4/c1-19-14-8-10(21-2)4-6-12(14)17-16(18(19)20)13-7-5-11(22-3)9-15(13)23-17/h4-9H,1-3H3
InChIKeySBEKYZCFCAIVOB-UHFFFAOYSA-N
XLogP3.46
TPSA53.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.32
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3,4,7-trimethoxy-1-methylquinolin-2-one
CID 20676861
3,8-dimethoxy-5-methylphenanthridin-6-one
CID 164597930
9-hydroxy-3-methoxy-[1]benzofuro[3,2-c]chromen-6-one
CID 131750884
7,17-dimethoxy-10,14-dioxapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4(9),5,7,11,15(20),16,18-nonaene-2,12-diol
CID 101286257
4-hydroxy-3,7-dimethoxy-1-methylquinolin-2-one
CID 54737447
methyl 6-methoxy-4-methylfuro[3,2-b]indole-2-carboxylate
CID 132587331
7-methoxy-2,12,17-trimethyl-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaene
CID 144582480
2-(4-bromophenyl)-7-methoxychromen-4-one
CID 25032618
3-(aminomethyl)-7-methoxy-1,4-dimethylquinolin-2-one
CID 84626906
6-methoxy-4-methyl-1H-quinoxaline-2,3-dione
CID 13437023
6,20-dimethoxy-13-phenyl-9,17-dioxa-1-azaheptacyclo[13.9.1.02,10.03,8.011,25.016,24.018,23]pentacosa-2(10),3(8),4,6,11,13,15(25),16(24),18(23),19,21-undecaene
CID 167209764
9-methoxy-6-phenylnaphtho[2,1-b][1]benzofuran
CID 155128175

Frequently Asked Questions

What is the IUPAC name of 3,9-dimethoxy-5-methyl-[1]benzofuro[3,2-c]quinolin-6-one?
The IUPAC name of 3,9-dimethoxy-5-methyl-[1]benzofuro[3,2-c]quinolin-6-one (CID 2794540) is 3,9-dimethoxy-5-methyl-[1]benzofuro[3,2-c]quinolin-6-one.
What is the SMILES notation for 3,9-dimethoxy-5-methyl-[1]benzofuro[3,2-c]quinolin-6-one?
The canonical SMILES for 3,9-dimethoxy-5-methyl-[1]benzofuro[3,2-c]quinolin-6-one is COc1ccc2c(c1)oc1c3ccc(OC)cc3n(C)c(=O)c21.
What is the InChIKey of 3,9-dimethoxy-5-methyl-[1]benzofuro[3,2-c]quinolin-6-one?
The InChIKey is SBEKYZCFCAIVOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO4/c1-19-14-8-10(21-2)4-6-12(14)17-16(18(19)20)13-7-5-11(22-3)9-15(13)23-17/h4-9H,1-3H3.
What are the key properties of 3,9-dimethoxy-5-methyl-[1]benzofuro[3,2-c]quinolin-6-one?
3,9-dimethoxy-5-methyl-[1]benzofuro[3,2-c]quinolin-6-one has a molecular weight of 309.32 g/mol, XLogP of 3.46, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,9-dimethoxy-5-methyl-[1]benzofuro[3,2-c]quinolin-6-one is sourced from PubChem (CID 2794540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).