N-(3,5-dimethylphenyl)-2-quinolin-8-ylacetamide

C19H18N2O — CID 51307005

IUPACN-(3,5-dimethylphenyl)-2-quinolin-8-ylacetamide
SMILESCc1cc(C)cc(NC(=O)Cc2cccc3cccnc23)c1
InChIInChI=1S/C19H18N2O/c1-13-9-14(2)11-17(10-13)21-18(22)12-16-6-3-5-15-7-4-8-20-19(15)16/h3-11H,12H2,1-2H3,(H,21,22)
InChIKeyDBODLWJWODFGHD-UHFFFAOYSA-N
MW290.37 g/mol
LogP4.03
Rot. Bonds3

About N-(3,5-dimethylphenyl)-2-quinolin-8-ylacetamide

N-(3,5-dimethylphenyl)-2-quinolin-8-ylacetamide (PubChem CID 51307005) has the molecular formula C19H18N2O and a molecular weight of 290.37 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-2-quinolin-8-ylacetamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-2-quinolin-8-ylacetamide
PubChem CID51307005
Molecular FormulaC19H18N2O
Molecular Weight290.37 g/mol
Exact Mass290.14
IUPAC NameN-(3,5-dimethylphenyl)-2-quinolin-8-ylacetamide
SMILESCc1cc(C)cc(NC(=O)Cc2cccc3cccnc23)c1
InChIInChI=1S/C19H18N2O/c1-13-9-14(2)11-17(10-13)21-18(22)12-16-6-3-5-15-7-4-8-20-19(15)16/h3-11H,12H2,1-2H3,(H,21,22)
InChIKeyDBODLWJWODFGHD-UHFFFAOYSA-N
XLogP4.03
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-3-N-(quinolin-8-ylmethyl)benzene-1,3-diamine
CID 115980853
2-quinolin-8-yl-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 47017959
N-[4-methoxy-3-[(4-methoxyphenyl)sulfamoyl]phenyl]-2-quinolin-8-ylacetamide
CID 46571780
2-(3-methylphenyl)-N-quinolin-8-ylacetamide
CID 113098821
N-(4-chloro-2-fluorophenyl)-2-quinolin-8-ylacetamide
CID 24663705
N-[(1R)-1-(4-methylphenyl)propyl]-2-quinolin-8-ylacetamide
CID 51929652
N-[3-(cyclopropylmethoxymethyl)phenyl]-2-quinolin-8-ylacetamide
CID 48598885
N-(3,5-dimethylphenyl)-2-(3-methylphenyl)acetamide
CID 11839743
ethyl 2-quinolin-8-ylacetate
CID 52562898
4-methyl-N-(quinolin-8-ylmethyl)aniline
CID 28619601
bis(N-methyl-1-quinolin-8-ylmethanamine);oxalic acid
CID 121229149
2-(quinolin-8-ylmethylamino)propanoic acid
CID 43467362

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-2-quinolin-8-ylacetamide?
The IUPAC name of N-(3,5-dimethylphenyl)-2-quinolin-8-ylacetamide (CID 51307005) is N-(3,5-dimethylphenyl)-2-quinolin-8-ylacetamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-2-quinolin-8-ylacetamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-2-quinolin-8-ylacetamide is Cc1cc(C)cc(NC(=O)Cc2cccc3cccnc23)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-2-quinolin-8-ylacetamide?
The InChIKey is DBODLWJWODFGHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O/c1-13-9-14(2)11-17(10-13)21-18(22)12-16-6-3-5-15-7-4-8-20-19(15)16/h3-11H,12H2,1-2H3,(H,21,22).
What are the key properties of N-(3,5-dimethylphenyl)-2-quinolin-8-ylacetamide?
N-(3,5-dimethylphenyl)-2-quinolin-8-ylacetamide has a molecular weight of 290.37 g/mol, XLogP of 4.03, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-2-quinolin-8-ylacetamide is sourced from PubChem (CID 51307005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).