N-[8-methoxy-4-methyl-2-(3,4,5-trimethoxyphenyl)quinolin-5-yl]acetamide

C22H24N2O5 — CID 169421100

IUPACN-[8-methoxy-4-methyl-2-(3,4,5-trimethoxyphenyl)quinolin-5-yl]acetamide
SMILESCOc1cc(-c2cc(C)c3c(NC(C)=O)ccc(OC)c3n2)cc(OC)c1OC
InChIInChI=1S/C22H24N2O5/c1-12-9-16(14-10-18(27-4)22(29-6)19(11-14)28-5)24-21-17(26-3)8-7-15(20(12)21)23-13(2)25/h7-11H,1-6H3,(H,23,25)
InChIKeyJDQGKNXAGKWDKM-UHFFFAOYSA-N
MW396.44 g/mol
LogP4.20
Rot. Bonds6

About N-[8-methoxy-4-methyl-2-(3,4,5-trimethoxyphenyl)quinolin-5-yl]acetamide

N-[8-methoxy-4-methyl-2-(3,4,5-trimethoxyphenyl)quinolin-5-yl]acetamide (PubChem CID 169421100) has the molecular formula C22H24N2O5 and a molecular weight of 396.44 g/mol. Its IUPAC name is N-[8-methoxy-4-methyl-2-(3,4,5-trimethoxyphenyl)quinolin-5-yl]acetamide.

Molecular Properties

Compound NameN-[8-methoxy-4-methyl-2-(3,4,5-trimethoxyphenyl)quinolin-5-yl]acetamide
PubChem CID169421100
Molecular FormulaC22H24N2O5
Molecular Weight396.44 g/mol
Exact Mass396.17
IUPAC NameN-[8-methoxy-4-methyl-2-(3,4,5-trimethoxyphenyl)quinolin-5-yl]acetamide
SMILESCOc1cc(-c2cc(C)c3c(NC(C)=O)ccc(OC)c3n2)cc(OC)c1OC
InChIInChI=1S/C22H24N2O5/c1-12-9-16(14-10-18(27-4)22(29-6)19(11-14)28-5)24-21-17(26-3)8-7-15(20(12)21)23-13(2)25/h7-11H,1-6H3,(H,23,25)
InChIKeyJDQGKNXAGKWDKM-UHFFFAOYSA-N
XLogP4.20
TPSA78.91 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.44
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[8-methoxy-4-methyl-2-(5-methylfuran-2-yl)quinolin-5-yl]acetamide
CID 169411948
N-[2-(4-hydroxy-3,5-dimethoxyphenyl)-4,8-dimethylquinolin-5-yl]propanamide
CID 169421802
formic acid;N-[8-methoxy-4-methyl-2-[2-(pyrazol-1-ylmethyl)phenyl]quinolin-5-yl]acetamide
CID 171339064
4-methoxy-6-(3,4,5-trimethoxyphenyl)pyridine-2-carboxylic acid
CID 12785004
N-(3-chloro-2,4-dimethoxyphenyl)acetamide
CID 91691937
N-(2-chloro-4-methylphenyl)-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide
CID 2347439
N-(2-methylquinolin-4-yl)-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide
CID 3900592
N-[2-methoxy-5-[3-(3,4,5-trimethoxyphenyl)thiophen-2-yl]phenyl]acetamide
CID 141187798
5,6-dimethyl-2-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide
CID 77094690
N-[2-[2-methoxy-5-[5-(3,4,5-trimethoxyphenyl)-2H-triazol-4-yl]anilino]-2-oxoethyl]butanamide
CID 59430200
N-[6-methoxy-4-methyl-2-(1-methylpyrazol-4-yl)quinolin-7-yl]acetamide
CID 169414607
N-[4-pyridin-2-yl-2-(3,4,5-trimethoxybenzoyl)phenyl]acetamide
CID 25066423

Frequently Asked Questions

What is the IUPAC name of N-[8-methoxy-4-methyl-2-(3,4,5-trimethoxyphenyl)quinolin-5-yl]acetamide?
The IUPAC name of N-[8-methoxy-4-methyl-2-(3,4,5-trimethoxyphenyl)quinolin-5-yl]acetamide (CID 169421100) is N-[8-methoxy-4-methyl-2-(3,4,5-trimethoxyphenyl)quinolin-5-yl]acetamide.
What is the SMILES notation for N-[8-methoxy-4-methyl-2-(3,4,5-trimethoxyphenyl)quinolin-5-yl]acetamide?
The canonical SMILES for N-[8-methoxy-4-methyl-2-(3,4,5-trimethoxyphenyl)quinolin-5-yl]acetamide is COc1cc(-c2cc(C)c3c(NC(C)=O)ccc(OC)c3n2)cc(OC)c1OC.
What is the InChIKey of N-[8-methoxy-4-methyl-2-(3,4,5-trimethoxyphenyl)quinolin-5-yl]acetamide?
The InChIKey is JDQGKNXAGKWDKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O5/c1-12-9-16(14-10-18(27-4)22(29-6)19(11-14)28-5)24-21-17(26-3)8-7-15(20(12)21)23-13(2)25/h7-11H,1-6H3,(H,23,25).
What are the key properties of N-[8-methoxy-4-methyl-2-(3,4,5-trimethoxyphenyl)quinolin-5-yl]acetamide?
N-[8-methoxy-4-methyl-2-(3,4,5-trimethoxyphenyl)quinolin-5-yl]acetamide has a molecular weight of 396.44 g/mol, XLogP of 4.20, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[8-methoxy-4-methyl-2-(3,4,5-trimethoxyphenyl)quinolin-5-yl]acetamide is sourced from PubChem (CID 169421100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).