2-[3-(dimethylamino)piperidin-1-yl]-N-(2-quinolin-8-ylethyl)acetamide

C20H28N4O — CID 138999931

IUPAC2-[3-(dimethylamino)piperidin-1-yl]-N-(2-quinolin-8-ylethyl)acetamide
SMILESCN(C)C1CCCN(CC(=O)NCCc2cccc3cccnc23)C1
InChIInChI=1S/C20H28N4O/c1-23(2)18-9-5-13-24(14-18)15-19(25)21-12-10-17-7-3-6-16-8-4-11-22-20(16)17/h3-4,6-8,11,18H,5,9-10,12-15H2,1-2H3,(H,21,25)
InChIKeyFLZCAKHLPSEVIV-UHFFFAOYSA-N
MW340.47 g/mol
LogP1.92
Rot. Bonds6

About 2-[3-(dimethylamino)piperidin-1-yl]-N-(2-quinolin-8-ylethyl)acetamide

2-[3-(dimethylamino)piperidin-1-yl]-N-(2-quinolin-8-ylethyl)acetamide (PubChem CID 138999931) has the molecular formula C20H28N4O and a molecular weight of 340.47 g/mol. Its IUPAC name is 2-[3-(dimethylamino)piperidin-1-yl]-N-(2-quinolin-8-ylethyl)acetamide.

Molecular Properties

Compound Name2-[3-(dimethylamino)piperidin-1-yl]-N-(2-quinolin-8-ylethyl)acetamide
PubChem CID138999931
Molecular FormulaC20H28N4O
Molecular Weight340.47 g/mol
Exact Mass340.23
IUPAC Name2-[3-(dimethylamino)piperidin-1-yl]-N-(2-quinolin-8-ylethyl)acetamide
SMILESCN(C)C1CCCN(CC(=O)NCCc2cccc3cccnc23)C1
InChIInChI=1S/C20H28N4O/c1-23(2)18-9-5-13-24(14-18)15-19(25)21-12-10-17-7-3-6-16-8-4-11-22-20(16)17/h3-4,6-8,11,18H,5,9-10,12-15H2,1-2H3,(H,21,25)
InChIKeyFLZCAKHLPSEVIV-UHFFFAOYSA-N
XLogP1.92
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.47
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[ethylsulfonyl(methyl)amino]piperidin-1-yl]-N-(2-quinolin-8-ylethyl)acetamide
CID 86903057
2-(4-phenyl-1,4-diazepan-1-yl)-N-(2-quinolin-8-ylethyl)acetamide
CID 87019726
1-methylsulfonyl-N-(2-quinolin-8-ylethyl)pyrrolidine-2-carboxamide
CID 53498297
N-(2-quinolin-8-ylethyl)-2-[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperazin-1-yl]acetamide
CID 86895240
N-(1-ethylpyrazol-4-yl)-1-[2-oxo-2-(2-quinolin-8-ylethylamino)ethyl]piperidine-4-carboxamide
CID 86881963
3-methyl-N-(2-quinolin-8-ylethyl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide
CID 86947753
2-[2-oxo-2-(2-quinolin-8-ylethylamino)ethoxy]-N-(2-quinolin-8-ylethyl)acetamide
CID 78847250
N-(2-quinolin-8-ylethyl)cyclohexanecarboxamide
CID 18149258
2-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)-N-(2-quinolin-8-ylethyl)acetamide
CID 46434974
2-(2-pyrrolidin-1-ylpropoxy)-N-(2-quinolin-8-ylethyl)acetamide
CID 126819530
2-[4-(1,3-benzoxazol-2-yl)piperazin-1-yl]-N-(2-quinolin-8-ylethyl)acetamide
CID 86894891
N-(1-ethylpiperidin-3-yl)-N-(quinolin-8-ylmethyl)prop-2-enamide
CID 154879689

Frequently Asked Questions

What is the IUPAC name of 2-[3-(dimethylamino)piperidin-1-yl]-N-(2-quinolin-8-ylethyl)acetamide?
The IUPAC name of 2-[3-(dimethylamino)piperidin-1-yl]-N-(2-quinolin-8-ylethyl)acetamide (CID 138999931) is 2-[3-(dimethylamino)piperidin-1-yl]-N-(2-quinolin-8-ylethyl)acetamide.
What is the SMILES notation for 2-[3-(dimethylamino)piperidin-1-yl]-N-(2-quinolin-8-ylethyl)acetamide?
The canonical SMILES for 2-[3-(dimethylamino)piperidin-1-yl]-N-(2-quinolin-8-ylethyl)acetamide is CN(C)C1CCCN(CC(=O)NCCc2cccc3cccnc23)C1.
What is the InChIKey of 2-[3-(dimethylamino)piperidin-1-yl]-N-(2-quinolin-8-ylethyl)acetamide?
The InChIKey is FLZCAKHLPSEVIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4O/c1-23(2)18-9-5-13-24(14-18)15-19(25)21-12-10-17-7-3-6-16-8-4-11-22-20(16)17/h3-4,6-8,11,18H,5,9-10,12-15H2,1-2H3,(H,21,25).
What are the key properties of 2-[3-(dimethylamino)piperidin-1-yl]-N-(2-quinolin-8-ylethyl)acetamide?
2-[3-(dimethylamino)piperidin-1-yl]-N-(2-quinolin-8-ylethyl)acetamide has a molecular weight of 340.47 g/mol, XLogP of 1.92, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(dimethylamino)piperidin-1-yl]-N-(2-quinolin-8-ylethyl)acetamide is sourced from PubChem (CID 138999931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).