7-methoxy-4-(4-methoxyphenyl)-4,5-dihydropyrrolo[1,2-a]quinoxaline

C19H18N2O2 — CID 2814081

IUPAC7-methoxy-4-(4-methoxyphenyl)-4,5-dihydropyrrolo[1,2-a]quinoxaline
SMILESCOc1ccc(C2Nc3cc(OC)ccc3-n3cccc32)cc1
InChIInChI=1S/C19H18N2O2/c1-22-14-7-5-13(6-8-14)19-18-4-3-11-21(18)17-10-9-15(23-2)12-16(17)20-19/h3-12,19-20H,1-2H3
InChIKeyLBJJKESXWWPXKL-UHFFFAOYSA-N
MW306.37 g/mol
LogP4.01
Rot. Bonds3

About 7-methoxy-4-(4-methoxyphenyl)-4,5-dihydropyrrolo[1,2-a]quinoxaline

7-methoxy-4-(4-methoxyphenyl)-4,5-dihydropyrrolo[1,2-a]quinoxaline (PubChem CID 2814081) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is 7-methoxy-4-(4-methoxyphenyl)-4,5-dihydropyrrolo[1,2-a]quinoxaline.

Molecular Properties

Compound Name7-methoxy-4-(4-methoxyphenyl)-4,5-dihydropyrrolo[1,2-a]quinoxaline
PubChem CID2814081
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC Name7-methoxy-4-(4-methoxyphenyl)-4,5-dihydropyrrolo[1,2-a]quinoxaline
SMILESCOc1ccc(C2Nc3cc(OC)ccc3-n3cccc32)cc1
InChIInChI=1S/C19H18N2O2/c1-22-14-7-5-13(6-8-14)19-18-4-3-11-21(18)17-10-9-15(23-2)12-16(17)20-19/h3-12,19-20H,1-2H3
InChIKeyLBJJKESXWWPXKL-UHFFFAOYSA-N
XLogP4.01
TPSA35.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-4-(4-methoxyphenyl)-4,5-dihydropyrrolo[1,2-a]quinoxaline?
The IUPAC name of 7-methoxy-4-(4-methoxyphenyl)-4,5-dihydropyrrolo[1,2-a]quinoxaline (CID 2814081) is 7-methoxy-4-(4-methoxyphenyl)-4,5-dihydropyrrolo[1,2-a]quinoxaline.
What is the SMILES notation for 7-methoxy-4-(4-methoxyphenyl)-4,5-dihydropyrrolo[1,2-a]quinoxaline?
The canonical SMILES for 7-methoxy-4-(4-methoxyphenyl)-4,5-dihydropyrrolo[1,2-a]quinoxaline is COc1ccc(C2Nc3cc(OC)ccc3-n3cccc32)cc1.
What is the InChIKey of 7-methoxy-4-(4-methoxyphenyl)-4,5-dihydropyrrolo[1,2-a]quinoxaline?
The InChIKey is LBJJKESXWWPXKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2/c1-22-14-7-5-13(6-8-14)19-18-4-3-11-21(18)17-10-9-15(23-2)12-16(17)20-19/h3-12,19-20H,1-2H3.
What are the key properties of 7-methoxy-4-(4-methoxyphenyl)-4,5-dihydropyrrolo[1,2-a]quinoxaline?
7-methoxy-4-(4-methoxyphenyl)-4,5-dihydropyrrolo[1,2-a]quinoxaline has a molecular weight of 306.37 g/mol, XLogP of 4.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-4-(4-methoxyphenyl)-4,5-dihydropyrrolo[1,2-a]quinoxaline is sourced from PubChem (CID 2814081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).