4-methoxy-2-[2-(5-methoxy-2-nitrosophenyl)ethyl]-1-nitrosobenzene

C16H16N2O4 — CID 11822705

IUPAC4-methoxy-2-[2-(5-methoxy-2-nitrosophenyl)ethyl]-1-nitrosobenzene
SMILESCOc1ccc(N=O)c(CCc2cc(OC)ccc2N=O)c1
InChIInChI=1S/C16H16N2O4/c1-21-13-5-7-15(17-19)11(9-13)3-4-12-10-14(22-2)6-8-16(12)18-20/h5-10H,3-4H2,1-2H3
InChIKeyYPSXFMHXRZAGTG-UHFFFAOYSA-N
MW300.31 g/mol
LogP4.28
Rot. Bonds7

About 4-methoxy-2-[2-(5-methoxy-2-nitrosophenyl)ethyl]-1-nitrosobenzene

4-methoxy-2-[2-(5-methoxy-2-nitrosophenyl)ethyl]-1-nitrosobenzene (PubChem CID 11822705) has the molecular formula C16H16N2O4 and a molecular weight of 300.31 g/mol. Its IUPAC name is 4-methoxy-2-[2-(5-methoxy-2-nitrosophenyl)ethyl]-1-nitrosobenzene.

Molecular Properties

Compound Name4-methoxy-2-[2-(5-methoxy-2-nitrosophenyl)ethyl]-1-nitrosobenzene
PubChem CID11822705
Molecular FormulaC16H16N2O4
Molecular Weight300.31 g/mol
Exact Mass300.11
IUPAC Name4-methoxy-2-[2-(5-methoxy-2-nitrosophenyl)ethyl]-1-nitrosobenzene
SMILESCOc1ccc(N=O)c(CCc2cc(OC)ccc2N=O)c1
InChIInChI=1S/C16H16N2O4/c1-21-13-5-7-15(17-19)11(9-13)3-4-12-10-14(22-2)6-8-16(12)18-20/h5-10H,3-4H2,1-2H3
InChIKeyYPSXFMHXRZAGTG-UHFFFAOYSA-N
XLogP4.28
TPSA77.32 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.31
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-Methyl-4-methoxyaniline
CID 7610
3-Methyl-4-nitroanisole
CID 79330
Benzene, 1,4-dimethoxy-2-[2-(4-nitrophenyl)ethenyl]-
CID 84250
1,4-Dimethoxy-2-((1E)-2-(4-nitrophenyl)ethenyl)benzene
CID 5802007
p-(Benzyloxy)nitrobenzene
CID 70842
Methyl 4-nitronaphthyl ether
CID 78613
2,6-Bis(1-methylethyl)-4-phenoxybenzenamine
CID 13272139
4-(Benzyloxy)-2-methyl-1-nitrobenzene
CID 257720
(E)-3-Methoxy-4'-nitrostilbene
CID 6440430
Benzene, 1-methyl-3-(4-nitrophenyl)-
CID 16816
2-Methoxy-4-methyl-1-{2-[2-(4-nitrophenoxy)ethoxy]ethoxy}benzene
CID 2282892
1,2-Dimethoxy-4-[2-(4-nitrophenyl)ethyl]benzene
CID 19936364

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-[2-(5-methoxy-2-nitrosophenyl)ethyl]-1-nitrosobenzene?
The IUPAC name of 4-methoxy-2-[2-(5-methoxy-2-nitrosophenyl)ethyl]-1-nitrosobenzene (CID 11822705) is 4-methoxy-2-[2-(5-methoxy-2-nitrosophenyl)ethyl]-1-nitrosobenzene.
What is the SMILES notation for 4-methoxy-2-[2-(5-methoxy-2-nitrosophenyl)ethyl]-1-nitrosobenzene?
The canonical SMILES for 4-methoxy-2-[2-(5-methoxy-2-nitrosophenyl)ethyl]-1-nitrosobenzene is COc1ccc(N=O)c(CCc2cc(OC)ccc2N=O)c1.
What is the InChIKey of 4-methoxy-2-[2-(5-methoxy-2-nitrosophenyl)ethyl]-1-nitrosobenzene?
The InChIKey is YPSXFMHXRZAGTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O4/c1-21-13-5-7-15(17-19)11(9-13)3-4-12-10-14(22-2)6-8-16(12)18-20/h5-10H,3-4H2,1-2H3.
What are the key properties of 4-methoxy-2-[2-(5-methoxy-2-nitrosophenyl)ethyl]-1-nitrosobenzene?
4-methoxy-2-[2-(5-methoxy-2-nitrosophenyl)ethyl]-1-nitrosobenzene has a molecular weight of 300.31 g/mol, XLogP of 4.28, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-[2-(5-methoxy-2-nitrosophenyl)ethyl]-1-nitrosobenzene is sourced from PubChem (CID 11822705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).