2-(4-methoxyphenyl)-N-methyl-N-(quinolin-3-ylmethyl)acetamide

C20H20N2O2 — CID 110733880

IUPAC2-(4-methoxyphenyl)-N-methyl-N-(quinolin-3-ylmethyl)acetamide
SMILESCOc1ccc(CC(=O)N(C)Cc2cnc3ccccc3c2)cc1
InChIInChI=1S/C20H20N2O2/c1-22(20(23)12-15-7-9-18(24-2)10-8-15)14-16-11-17-5-3-4-6-19(17)21-13-16/h3-11,13H,12,14H2,1-2H3
InChIKeyIFWRFUSKVZFGGD-UHFFFAOYSA-N
MW320.39 g/mol
LogP3.44
Rot. Bonds5

About 2-(4-methoxyphenyl)-N-methyl-N-(quinolin-3-ylmethyl)acetamide

2-(4-methoxyphenyl)-N-methyl-N-(quinolin-3-ylmethyl)acetamide (PubChem CID 110733880) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-N-methyl-N-(quinolin-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-N-methyl-N-(quinolin-3-ylmethyl)acetamide
PubChem CID110733880
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC Name2-(4-methoxyphenyl)-N-methyl-N-(quinolin-3-ylmethyl)acetamide
SMILESCOc1ccc(CC(=O)N(C)Cc2cnc3ccccc3c2)cc1
InChIInChI=1S/C20H20N2O2/c1-22(20(23)12-15-7-9-18(24-2)10-8-15)14-16-11-17-5-3-4-6-19(17)21-13-16/h3-11,13H,12,14H2,1-2H3
InChIKeyIFWRFUSKVZFGGD-UHFFFAOYSA-N
XLogP3.44
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dimethoxy-N-methyl-N-(quinolin-3-ylmethyl)benzamide
CID 110733874
(2R)-2-hydroxy-2-(4-methoxyphenyl)-N-methyl-N-(quinolin-3-ylmethyl)acetamide
CID 95230216
N-methyl-4-phenoxy-N-(quinolin-3-ylmethyl)butanamide
CID 110745516
N-[(4-methoxyphenyl)methyl]-N-methyl-2-(4-sulfanylphenyl)acetamide
CID 107024320
2-(4-fluorophenyl)-N-[(4-methoxyphenyl)methyl]-N-methylacetamide
CID 94010767
N-[(2-chlorophenyl)methyl]-2-(4-methoxyphenyl)-N-methylacetamide
CID 78768556
2-(4-methoxyphenyl)-N-methyl-N-(1,3-thiazol-2-ylmethyl)acetamide
CID 110715683
2-fluoro-N-methyl-N-(quinolin-3-ylmethyl)benzamide
CID 110733867
N-[2-(3-hydroxyphenyl)ethyl]-N-methyl-2-quinolin-3-ylacetamide
CID 166389029
2-(4-methoxyphenyl)-N-methyl-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
CID 78771326
N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylquinoline-2-carboxamide
CID 9482645
N-methyl-2-(4-methylphenyl)-N-(quinolin-3-ylmethyl)propanamide
CID 91781862

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-N-methyl-N-(quinolin-3-ylmethyl)acetamide?
The IUPAC name of 2-(4-methoxyphenyl)-N-methyl-N-(quinolin-3-ylmethyl)acetamide (CID 110733880) is 2-(4-methoxyphenyl)-N-methyl-N-(quinolin-3-ylmethyl)acetamide.
What is the SMILES notation for 2-(4-methoxyphenyl)-N-methyl-N-(quinolin-3-ylmethyl)acetamide?
The canonical SMILES for 2-(4-methoxyphenyl)-N-methyl-N-(quinolin-3-ylmethyl)acetamide is COc1ccc(CC(=O)N(C)Cc2cnc3ccccc3c2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-N-methyl-N-(quinolin-3-ylmethyl)acetamide?
The InChIKey is IFWRFUSKVZFGGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2/c1-22(20(23)12-15-7-9-18(24-2)10-8-15)14-16-11-17-5-3-4-6-19(17)21-13-16/h3-11,13H,12,14H2,1-2H3.
What are the key properties of 2-(4-methoxyphenyl)-N-methyl-N-(quinolin-3-ylmethyl)acetamide?
2-(4-methoxyphenyl)-N-methyl-N-(quinolin-3-ylmethyl)acetamide has a molecular weight of 320.39 g/mol, XLogP of 3.44, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-N-methyl-N-(quinolin-3-ylmethyl)acetamide is sourced from PubChem (CID 110733880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).