N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-2-quinolin-8-ylacetamide

C20H27N3O2 — CID 71879938

IUPACN-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-2-quinolin-8-ylacetamide
SMILESCOCCN1CCC(CNC(=O)Cc2cccc3cccnc23)CC1
InChIInChI=1S/C20H27N3O2/c1-25-13-12-23-10-7-16(8-11-23)15-22-19(24)14-18-5-2-4-17-6-3-9-21-20(17)18/h2-6,9,16H,7-8,10-15H2,1H3,(H,22,24)
InChIKeyINXKBZJQOKMQRV-UHFFFAOYSA-N
MW341.45 g/mol
LogP2.25
Rot. Bonds7

About N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-2-quinolin-8-ylacetamide

N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-2-quinolin-8-ylacetamide (PubChem CID 71879938) has the molecular formula C20H27N3O2 and a molecular weight of 341.45 g/mol. Its IUPAC name is N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-2-quinolin-8-ylacetamide.

Molecular Properties

Compound NameN-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-2-quinolin-8-ylacetamide
PubChem CID71879938
Molecular FormulaC20H27N3O2
Molecular Weight341.45 g/mol
Exact Mass341.21
IUPAC NameN-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-2-quinolin-8-ylacetamide
SMILESCOCCN1CCC(CNC(=O)Cc2cccc3cccnc23)CC1
InChIInChI=1S/C20H27N3O2/c1-25-13-12-23-10-7-16(8-11-23)15-22-19(24)14-18-5-2-4-17-6-3-9-21-20(17)18/h2-6,9,16H,7-8,10-15H2,1H3,(H,22,24)
InChIKeyINXKBZJQOKMQRV-UHFFFAOYSA-N
XLogP2.25
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.45
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-2-(6-methyl-3-pyridinyl)acetamide
CID 71880016
N-methyl-2-[4-(quinolin-8-ylmethyl)piperidin-1-yl]acetamide
CID 110090460
N-(2-methoxyethyl)-2-(quinolin-8-ylmethylamino)acetamide
CID 112723633
N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-6-methylpyridine-3-carboxamide
CID 71880041
N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-1H-indazole-7-carboxamide
CID 71879940
N-[2-(4-methoxyphenoxy)ethyl]-2-quinolin-8-ylacetamide
CID 134036124
2-methoxy-N-(quinolin-8-ylmethyl)acetamide
CID 47468683
4-methoxy-N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]benzamide
CID 16895498
N-(2-methyl-3-pyrrolidin-1-ylpropyl)-2-quinolin-8-ylacetamide
CID 86824127
N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]butyl]-2-quinolin-8-ylacetamide
CID 95974785
(2R)-2-methoxy-N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-2-phenylacetamide
CID 97062875
N-[(1-phenylpyrrolidin-3-yl)methyl]-2-[4-(quinolin-8-ylmethyl)piperazin-1-yl]acetamide
CID 75404078

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-2-quinolin-8-ylacetamide?
The IUPAC name of N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-2-quinolin-8-ylacetamide (CID 71879938) is N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-2-quinolin-8-ylacetamide.
What is the SMILES notation for N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-2-quinolin-8-ylacetamide?
The canonical SMILES for N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-2-quinolin-8-ylacetamide is COCCN1CCC(CNC(=O)Cc2cccc3cccnc23)CC1.
What is the InChIKey of N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-2-quinolin-8-ylacetamide?
The InChIKey is INXKBZJQOKMQRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O2/c1-25-13-12-23-10-7-16(8-11-23)15-22-19(24)14-18-5-2-4-17-6-3-9-21-20(17)18/h2-6,9,16H,7-8,10-15H2,1H3,(H,22,24).
What are the key properties of N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-2-quinolin-8-ylacetamide?
N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-2-quinolin-8-ylacetamide has a molecular weight of 341.45 g/mol, XLogP of 2.25, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-2-quinolin-8-ylacetamide is sourced from PubChem (CID 71879938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).