5,10-dimethoxy-4,5-dimethyl-1H-chromeno[3,4-f]quinolin-2-one

C20H19NO4 — CID 25017240

IUPAC5,10-dimethoxy-4,5-dimethyl-1H-chromeno[3,4-f]quinolin-2-one
SMILESCOc1cccc2c1-c1ccc3[nH]c(=O)cc(C)c3c1C(C)(OC)O2
InChIInChI=1S/C20H19NO4/c1-11-10-16(22)21-13-9-8-12-18-14(23-3)6-5-7-15(18)25-20(2,24-4)19(12)17(11)13/h5-10H,1-4H3,(H,21,22)
InChIKeyATWBVUJXKYZKHP-UHFFFAOYSA-N
MW337.38 g/mol
LogP3.72
Rot. Bonds2

About 5,10-dimethoxy-4,5-dimethyl-1H-chromeno[3,4-f]quinolin-2-one

5,10-dimethoxy-4,5-dimethyl-1H-chromeno[3,4-f]quinolin-2-one (PubChem CID 25017240) has the molecular formula C20H19NO4 and a molecular weight of 337.38 g/mol. Its IUPAC name is 5,10-dimethoxy-4,5-dimethyl-1H-chromeno[3,4-f]quinolin-2-one.

Molecular Properties

Compound Name5,10-dimethoxy-4,5-dimethyl-1H-chromeno[3,4-f]quinolin-2-one
PubChem CID25017240
Molecular FormulaC20H19NO4
Molecular Weight337.38 g/mol
Exact Mass337.13
IUPAC Name5,10-dimethoxy-4,5-dimethyl-1H-chromeno[3,4-f]quinolin-2-one
SMILESCOc1cccc2c1-c1ccc3[nH]c(=O)cc(C)c3c1C(C)(OC)O2
InChIInChI=1S/C20H19NO4/c1-11-10-16(22)21-13-9-8-12-18-14(23-3)6-5-7-15(18)25-20(2,24-4)19(12)17(11)13/h5-10H,1-4H3,(H,21,22)
InChIKeyATWBVUJXKYZKHP-UHFFFAOYSA-N
XLogP3.72
TPSA60.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5,10-dimethoxy-4,5-dimethyl-1H-chromeno[3,4-f]quinolin-2-one?
The IUPAC name of 5,10-dimethoxy-4,5-dimethyl-1H-chromeno[3,4-f]quinolin-2-one (CID 25017240) is 5,10-dimethoxy-4,5-dimethyl-1H-chromeno[3,4-f]quinolin-2-one.
What is the SMILES notation for 5,10-dimethoxy-4,5-dimethyl-1H-chromeno[3,4-f]quinolin-2-one?
The canonical SMILES for 5,10-dimethoxy-4,5-dimethyl-1H-chromeno[3,4-f]quinolin-2-one is COc1cccc2c1-c1ccc3[nH]c(=O)cc(C)c3c1C(C)(OC)O2.
What is the InChIKey of 5,10-dimethoxy-4,5-dimethyl-1H-chromeno[3,4-f]quinolin-2-one?
The InChIKey is ATWBVUJXKYZKHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO4/c1-11-10-16(22)21-13-9-8-12-18-14(23-3)6-5-7-15(18)25-20(2,24-4)19(12)17(11)13/h5-10H,1-4H3,(H,21,22).
What are the key properties of 5,10-dimethoxy-4,5-dimethyl-1H-chromeno[3,4-f]quinolin-2-one?
5,10-dimethoxy-4,5-dimethyl-1H-chromeno[3,4-f]quinolin-2-one has a molecular weight of 337.38 g/mol, XLogP of 3.72, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,10-dimethoxy-4,5-dimethyl-1H-chromeno[3,4-f]quinolin-2-one is sourced from PubChem (CID 25017240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).