N-[2-(3-hydroxyphenyl)ethyl]-N-methyl-2-quinolin-3-ylacetamide

C20H20N2O2 — CID 166389029

IUPACN-[2-(3-hydroxyphenyl)ethyl]-N-methyl-2-quinolin-3-ylacetamide
SMILESCN(CCc1cccc(O)c1)C(=O)Cc1cnc2ccccc2c1
InChIInChI=1S/C20H20N2O2/c1-22(10-9-15-5-4-7-18(23)12-15)20(24)13-16-11-17-6-2-3-8-19(17)21-14-16/h2-8,11-12,14,23H,9-10,13H2,1H3
InChIKeyZENZFABRFRKYIL-UHFFFAOYSA-N
MW320.39 g/mol
LogP3.18
Rot. Bonds5

About N-[2-(3-hydroxyphenyl)ethyl]-N-methyl-2-quinolin-3-ylacetamide

N-[2-(3-hydroxyphenyl)ethyl]-N-methyl-2-quinolin-3-ylacetamide (PubChem CID 166389029) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is N-[2-(3-hydroxyphenyl)ethyl]-N-methyl-2-quinolin-3-ylacetamide.

Molecular Properties

Compound NameN-[2-(3-hydroxyphenyl)ethyl]-N-methyl-2-quinolin-3-ylacetamide
PubChem CID166389029
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC NameN-[2-(3-hydroxyphenyl)ethyl]-N-methyl-2-quinolin-3-ylacetamide
SMILESCN(CCc1cccc(O)c1)C(=O)Cc1cnc2ccccc2c1
InChIInChI=1S/C20H20N2O2/c1-22(10-9-15-5-4-7-18(23)12-15)20(24)13-16-11-17-6-2-3-8-19(17)21-14-16/h2-8,11-12,14,23H,9-10,13H2,1H3
InChIKeyZENZFABRFRKYIL-UHFFFAOYSA-N
XLogP3.18
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxyphenyl)-N-methyl-N-(quinolin-3-ylmethyl)acetamide
CID 110733880
3-hydroxy-N-(quinolin-3-ylmethyl)benzamide
CID 110472397
2-(3-aminophenyl)-N-methyl-N-(2-phenylethyl)acetamide
CID 62499017
2-(3-hydroxyphenyl)-N-methyl-N-pent-4-enylacetamide
CID 113239258
quinolin-3-ylmethyl acetate
CID 101032812
N-[2-(3,5-dimethylpyrazolidin-4-yl)ethyl]-2-(3-hydroxyphenyl)-N-methylacetamide
CID 133108337
2-quinolin-3-ylethanol
CID 53403774
2-(3-hydroxyphenyl)-N-methyl-N-[(4-methylphenyl)methyl]acetamide
CID 61399859
N-methyl-4-phenoxy-N-(quinolin-3-ylmethyl)butanamide
CID 110745516
2-ethyl-N-(quinolin-3-ylmethyl)butanamide
CID 110733756
2-fluoro-N-methyl-N-(quinolin-3-ylmethyl)benzamide
CID 110733867
2-(3-methylphenyl)-N-(quinolin-3-ylmethyl)acetamide
CID 110733803

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-hydroxyphenyl)ethyl]-N-methyl-2-quinolin-3-ylacetamide?
The IUPAC name of N-[2-(3-hydroxyphenyl)ethyl]-N-methyl-2-quinolin-3-ylacetamide (CID 166389029) is N-[2-(3-hydroxyphenyl)ethyl]-N-methyl-2-quinolin-3-ylacetamide.
What is the SMILES notation for N-[2-(3-hydroxyphenyl)ethyl]-N-methyl-2-quinolin-3-ylacetamide?
The canonical SMILES for N-[2-(3-hydroxyphenyl)ethyl]-N-methyl-2-quinolin-3-ylacetamide is CN(CCc1cccc(O)c1)C(=O)Cc1cnc2ccccc2c1.
What is the InChIKey of N-[2-(3-hydroxyphenyl)ethyl]-N-methyl-2-quinolin-3-ylacetamide?
The InChIKey is ZENZFABRFRKYIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2/c1-22(10-9-15-5-4-7-18(23)12-15)20(24)13-16-11-17-6-2-3-8-19(17)21-14-16/h2-8,11-12,14,23H,9-10,13H2,1H3.
What are the key properties of N-[2-(3-hydroxyphenyl)ethyl]-N-methyl-2-quinolin-3-ylacetamide?
N-[2-(3-hydroxyphenyl)ethyl]-N-methyl-2-quinolin-3-ylacetamide has a molecular weight of 320.39 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-hydroxyphenyl)ethyl]-N-methyl-2-quinolin-3-ylacetamide is sourced from PubChem (CID 166389029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).