N-cycloheptyl-2-[5-methoxy-2-(morpholin-4-ylmethyl)-4-oxo-1-pyridinyl]acetamide

C20H31N3O4 — CID 71708974

IUPACN-cycloheptyl-2-[5-methoxy-2-(morpholin-4-ylmethyl)-4-oxo-1-pyridinyl]acetamide
SMILESCOc1cn(CC(=O)NC2CCCCCC2)c(CN2CCOCC2)cc1=O
InChIInChI=1S/C20H31N3O4/c1-26-19-14-23(15-20(25)21-16-6-4-2-3-5-7-16)17(12-18(19)24)13-22-8-10-27-11-9-22/h12,14,16H,2-11,13,15H2,1H3,(H,21,25)
InChIKeyWXPUUPHPMLKNQF-UHFFFAOYSA-N
MW377.49 g/mol
LogP1.53
Rot. Bonds6

About N-cycloheptyl-2-[5-methoxy-2-(morpholin-4-ylmethyl)-4-oxo-1-pyridinyl]acetamide

N-cycloheptyl-2-[5-methoxy-2-(morpholin-4-ylmethyl)-4-oxo-1-pyridinyl]acetamide (PubChem CID 71708974) has the molecular formula C20H31N3O4 and a molecular weight of 377.49 g/mol. Its IUPAC name is N-cycloheptyl-2-[5-methoxy-2-(morpholin-4-ylmethyl)-4-oxo-1-pyridinyl]acetamide.

Molecular Properties

Compound NameN-cycloheptyl-2-[5-methoxy-2-(morpholin-4-ylmethyl)-4-oxo-1-pyridinyl]acetamide
PubChem CID71708974
Molecular FormulaC20H31N3O4
Molecular Weight377.49 g/mol
Exact Mass377.23
IUPAC NameN-cycloheptyl-2-[5-methoxy-2-(morpholin-4-ylmethyl)-4-oxo-1-pyridinyl]acetamide
SMILESCOc1cn(CC(=O)NC2CCCCCC2)c(CN2CCOCC2)cc1=O
InChIInChI=1S/C20H31N3O4/c1-26-19-14-23(15-20(25)21-16-6-4-2-3-5-7-16)17(12-18(19)24)13-22-8-10-27-11-9-22/h12,14,16H,2-11,13,15H2,1H3,(H,21,25)
InChIKeyWXPUUPHPMLKNQF-UHFFFAOYSA-N
XLogP1.53
TPSA72.80 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.49
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(2-((4-acetylpiperazin-1-yl)methyl)-5-methoxy-4-oxopyridin-1(4H)-yl)-N-cyclohexylacetamide
CID 18566947
N-cyclohexyl-2-(5-methoxy-4-oxo-2-(piperidin-1-ylmethyl)pyridin-1(4H)-yl)acetamide
CID 44015419
N-isopropyl-2-[5-methoxy-4-oxo-2-(piperidin-1-ylmethyl)pyridin-1(4H)-yl]acetamide
CID 27532517
N-Cyclopentyl-2-{5-methoxy-4-oxo-2-[(piperidin-1-YL)methyl]-1,4-dihydropyridin-1-YL}acetamide
CID 44826930
N-cyclopentyl-2-(5-methoxy-2-(morpholinomethyl)-4-oxopyridin-1(4H)-yl)acetamide
CID 44894737
2-[5-methoxy-4-oxo-2-(piperidin-1-ylmethyl)-1-pyridinyl]-N-[[(2R)-oxolan-2-yl]methyl]acetamide
CID 93070104
(4-Hydroxy-5-methoxypyridin-2-yl)(morpholin-4-yl)methanone
CID 127254910
Ethyl 2-[[2-[5-methoxy-4-oxo-2-(piperidin-1-ylmethyl)-1-pyridinyl]acetyl]amino]acetate
CID 18566888
N-(2-methoxyethyl)-2-[5-methoxy-2-[(4-methylpiperidin-1-yl)methyl]-4-oxo-1-pyridinyl]acetamide
CID 18566899
N-(tert-butyl)-2-(5-methoxy-2-(morpholinomethyl)-4-oxopyridin-1(4H)-yl)acetamide
CID 18566902
2-(2-(azepan-1-ylmethyl)-5-methoxy-4-oxopyridin-1(4H)-yl)-N-isopropylacetamide
CID 27532519
2-[5-Methoxy-4-oxo-2-(piperidinomethyl)-1(4H)-pyridinyl]-N~1~-propylacetamide
CID 27636523

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-[5-methoxy-2-(morpholin-4-ylmethyl)-4-oxo-1-pyridinyl]acetamide?
The IUPAC name of N-cycloheptyl-2-[5-methoxy-2-(morpholin-4-ylmethyl)-4-oxo-1-pyridinyl]acetamide (CID 71708974) is N-cycloheptyl-2-[5-methoxy-2-(morpholin-4-ylmethyl)-4-oxo-1-pyridinyl]acetamide.
What is the SMILES notation for N-cycloheptyl-2-[5-methoxy-2-(morpholin-4-ylmethyl)-4-oxo-1-pyridinyl]acetamide?
The canonical SMILES for N-cycloheptyl-2-[5-methoxy-2-(morpholin-4-ylmethyl)-4-oxo-1-pyridinyl]acetamide is COc1cn(CC(=O)NC2CCCCCC2)c(CN2CCOCC2)cc1=O.
What is the InChIKey of N-cycloheptyl-2-[5-methoxy-2-(morpholin-4-ylmethyl)-4-oxo-1-pyridinyl]acetamide?
The InChIKey is WXPUUPHPMLKNQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N3O4/c1-26-19-14-23(15-20(25)21-16-6-4-2-3-5-7-16)17(12-18(19)24)13-22-8-10-27-11-9-22/h12,14,16H,2-11,13,15H2,1H3,(H,21,25).
What are the key properties of N-cycloheptyl-2-[5-methoxy-2-(morpholin-4-ylmethyl)-4-oxo-1-pyridinyl]acetamide?
N-cycloheptyl-2-[5-methoxy-2-(morpholin-4-ylmethyl)-4-oxo-1-pyridinyl]acetamide has a molecular weight of 377.49 g/mol, XLogP of 1.53, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-[5-methoxy-2-(morpholin-4-ylmethyl)-4-oxo-1-pyridinyl]acetamide is sourced from PubChem (CID 71708974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).