N-tert-butyl-2-[5-methoxy-2-[(4-methylpiperidin-1-yl)methyl]-4-oxo-1-pyridinyl]acetamide

C19H31N3O3 — CID 27603267

IUPACN-tert-butyl-2-[5-methoxy-2-[(4-methylpiperidin-1-yl)methyl]-4-oxo-1-pyridinyl]acetamide
SMILESCOc1cn(CC(=O)NC(C)(C)C)c(CN2CCC(C)CC2)cc1=O
InChIInChI=1S/C19H31N3O3/c1-14-6-8-21(9-7-14)11-15-10-16(23)17(25-5)12-22(15)13-18(24)20-19(2,3)4/h10,12,14H,6-9,11,13H2,1-5H3,(H,20,24)
InChIKeyPWWACWCVFKLNJS-UHFFFAOYSA-N
MW349.48 g/mol
LogP2.00
Rot. Bonds5

About N-tert-butyl-2-[5-methoxy-2-[(4-methylpiperidin-1-yl)methyl]-4-oxo-1-pyridinyl]acetamide

N-tert-butyl-2-[5-methoxy-2-[(4-methylpiperidin-1-yl)methyl]-4-oxo-1-pyridinyl]acetamide (PubChem CID 27603267) has the molecular formula C19H31N3O3 and a molecular weight of 349.48 g/mol. Its IUPAC name is N-tert-butyl-2-[5-methoxy-2-[(4-methylpiperidin-1-yl)methyl]-4-oxo-1-pyridinyl]acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-[5-methoxy-2-[(4-methylpiperidin-1-yl)methyl]-4-oxo-1-pyridinyl]acetamide
PubChem CID27603267
Molecular FormulaC19H31N3O3
Molecular Weight349.48 g/mol
Exact Mass349.24
IUPAC NameN-tert-butyl-2-[5-methoxy-2-[(4-methylpiperidin-1-yl)methyl]-4-oxo-1-pyridinyl]acetamide
SMILESCOc1cn(CC(=O)NC(C)(C)C)c(CN2CCC(C)CC2)cc1=O
InChIInChI=1S/C19H31N3O3/c1-14-6-8-21(9-7-14)11-15-10-16(23)17(25-5)12-22(15)13-18(24)20-19(2,3)4/h10,12,14H,6-9,11,13H2,1-5H3,(H,20,24)
InChIKeyPWWACWCVFKLNJS-UHFFFAOYSA-N
XLogP2.00
TPSA63.57 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.48
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-tert-butyl-2-[5-methoxy-2-[(4-methylpiperidin-1-yl)methyl]-4-oxo-1-pyridinyl]acetamide with MolForge

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Related Compounds

4-[(4-Hydroxy-5-methoxy-2-pyridinyl)methyl]-1-isobutyl-3-methyl-2-piperazinone
CID 56896852
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
2-(5-methoxy-4-oxo-2-(piperidin-1-ylmethyl)pyridin-1(4H)-yl)acetamide
CID 40829092
N-Cyclopentyl-2-{5-methoxy-4-oxo-2-[(piperidin-1-YL)methyl]-1,4-dihydropyridin-1-YL}acetamide
CID 44826930
5-methoxy-2-(4-methylpiperidine-1-carbonyl)pyridin-4(1H)-one
CID 125434328
N-cyclohexyl-2-(5-methoxy-2-((4-methylpiperidin-1-yl)methyl)-4-oxopyridin-1(4H)-yl)acetamide
CID 18566898
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-YL)methyl]-5-methoxy-4-oxo-14-dihydropyridin-1-YL}-N-tert-butylacetamide
CID 18566935
N-[2-(7-methoxy-1,8-dioxo-3,4-dihydropyrido[1,2-a]pyrazin-2-yl)ethyl]pentanamide
CID 27457075
N-(tert-butyl)-2-(5-methoxy-4-oxo-2-(piperidin-1-ylmethyl)pyridin-1(4H)-yl)acetamide
CID 27532178

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[5-methoxy-2-[(4-methylpiperidin-1-yl)methyl]-4-oxo-1-pyridinyl]acetamide?
The IUPAC name of N-tert-butyl-2-[5-methoxy-2-[(4-methylpiperidin-1-yl)methyl]-4-oxo-1-pyridinyl]acetamide (CID 27603267) is N-tert-butyl-2-[5-methoxy-2-[(4-methylpiperidin-1-yl)methyl]-4-oxo-1-pyridinyl]acetamide.
What is the SMILES notation for N-tert-butyl-2-[5-methoxy-2-[(4-methylpiperidin-1-yl)methyl]-4-oxo-1-pyridinyl]acetamide?
The canonical SMILES for N-tert-butyl-2-[5-methoxy-2-[(4-methylpiperidin-1-yl)methyl]-4-oxo-1-pyridinyl]acetamide is COc1cn(CC(=O)NC(C)(C)C)c(CN2CCC(C)CC2)cc1=O.
What is the InChIKey of N-tert-butyl-2-[5-methoxy-2-[(4-methylpiperidin-1-yl)methyl]-4-oxo-1-pyridinyl]acetamide?
The InChIKey is PWWACWCVFKLNJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N3O3/c1-14-6-8-21(9-7-14)11-15-10-16(23)17(25-5)12-22(15)13-18(24)20-19(2,3)4/h10,12,14H,6-9,11,13H2,1-5H3,(H,20,24).
What are the key properties of N-tert-butyl-2-[5-methoxy-2-[(4-methylpiperidin-1-yl)methyl]-4-oxo-1-pyridinyl]acetamide?
N-tert-butyl-2-[5-methoxy-2-[(4-methylpiperidin-1-yl)methyl]-4-oxo-1-pyridinyl]acetamide has a molecular weight of 349.48 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[5-methoxy-2-[(4-methylpiperidin-1-yl)methyl]-4-oxo-1-pyridinyl]acetamide is sourced from PubChem (CID 27603267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).