2-[5,7-dimethoxy-3-(4-methoxyphenyl)quinolin-2-yl]oxy-N,N-diethylacetamide

C24H28N2O5 — CID 10895157

IUPAC2-[5,7-dimethoxy-3-(4-methoxyphenyl)quinolin-2-yl]oxy-N,N-diethylacetamide
SMILESCCN(CC)C(=O)COc1nc2cc(OC)cc(OC)c2cc1-c1ccc(OC)cc1
InChIInChI=1S/C24H28N2O5/c1-6-26(7-2)23(27)15-31-24-19(16-8-10-17(28-3)11-9-16)14-20-21(25-24)12-18(29-4)13-22(20)30-5/h8-14H,6-7,15H2,1-5H3
InChIKeyGOJIVPRZIQFHIT-UHFFFAOYSA-N
MW424.50 g/mol
LogP4.17
Rot. Bonds9

About 2-[5,7-dimethoxy-3-(4-methoxyphenyl)quinolin-2-yl]oxy-N,N-diethylacetamide

2-[5,7-dimethoxy-3-(4-methoxyphenyl)quinolin-2-yl]oxy-N,N-diethylacetamide (PubChem CID 10895157) has the molecular formula C24H28N2O5 and a molecular weight of 424.50 g/mol. Its IUPAC name is 2-[5,7-dimethoxy-3-(4-methoxyphenyl)quinolin-2-yl]oxy-N,N-diethylacetamide.

Molecular Properties

Compound Name2-[5,7-dimethoxy-3-(4-methoxyphenyl)quinolin-2-yl]oxy-N,N-diethylacetamide
PubChem CID10895157
Molecular FormulaC24H28N2O5
Molecular Weight424.50 g/mol
Exact Mass424.20
IUPAC Name2-[5,7-dimethoxy-3-(4-methoxyphenyl)quinolin-2-yl]oxy-N,N-diethylacetamide
SMILESCCN(CC)C(=O)COc1nc2cc(OC)cc(OC)c2cc1-c1ccc(OC)cc1
InChIInChI=1S/C24H28N2O5/c1-6-26(7-2)23(27)15-31-24-19(16-8-10-17(28-3)11-9-16)14-20-21(25-24)12-18(29-4)13-22(20)30-5/h8-14H,6-7,15H2,1-5H3
InChIKeyGOJIVPRZIQFHIT-UHFFFAOYSA-N
XLogP4.17
TPSA70.12 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.50
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[5,7-dimethoxy-3-(4-methoxyphenyl)quinolin-2-yl]oxy-N,N-diethylacetamide?
The IUPAC name of 2-[5,7-dimethoxy-3-(4-methoxyphenyl)quinolin-2-yl]oxy-N,N-diethylacetamide (CID 10895157) is 2-[5,7-dimethoxy-3-(4-methoxyphenyl)quinolin-2-yl]oxy-N,N-diethylacetamide.
What is the SMILES notation for 2-[5,7-dimethoxy-3-(4-methoxyphenyl)quinolin-2-yl]oxy-N,N-diethylacetamide?
The canonical SMILES for 2-[5,7-dimethoxy-3-(4-methoxyphenyl)quinolin-2-yl]oxy-N,N-diethylacetamide is CCN(CC)C(=O)COc1nc2cc(OC)cc(OC)c2cc1-c1ccc(OC)cc1.
What is the InChIKey of 2-[5,7-dimethoxy-3-(4-methoxyphenyl)quinolin-2-yl]oxy-N,N-diethylacetamide?
The InChIKey is GOJIVPRZIQFHIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O5/c1-6-26(7-2)23(27)15-31-24-19(16-8-10-17(28-3)11-9-16)14-20-21(25-24)12-18(29-4)13-22(20)30-5/h8-14H,6-7,15H2,1-5H3.
What are the key properties of 2-[5,7-dimethoxy-3-(4-methoxyphenyl)quinolin-2-yl]oxy-N,N-diethylacetamide?
2-[5,7-dimethoxy-3-(4-methoxyphenyl)quinolin-2-yl]oxy-N,N-diethylacetamide has a molecular weight of 424.50 g/mol, XLogP of 4.17, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5,7-dimethoxy-3-(4-methoxyphenyl)quinolin-2-yl]oxy-N,N-diethylacetamide is sourced from PubChem (CID 10895157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).