N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-2-methoxyacetamide

C14H20N2O4 — CID 91783772

IUPACN-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-2-methoxyacetamide
SMILESCOCC(=O)NC(c1cncc(OC)c1)C1CC(O)C1
InChIInChI=1S/C14H20N2O4/c1-19-8-13(18)16-14(9-3-11(17)4-9)10-5-12(20-2)7-15-6-10/h5-7,9,11,14,17H,3-4,8H2,1-2H3,(H,16,18)
InChIKeyWQAMESJZOAXETQ-UHFFFAOYSA-N
MW280.32 g/mol
LogP0.66
Rot. Bonds6

About N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-2-methoxyacetamide

N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-2-methoxyacetamide (PubChem CID 91783772) has the molecular formula C14H20N2O4 and a molecular weight of 280.32 g/mol. Its IUPAC name is N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-2-methoxyacetamide
PubChem CID91783772
Molecular FormulaC14H20N2O4
Molecular Weight280.32 g/mol
Exact Mass280.14
IUPAC NameN-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-2-methoxyacetamide
SMILESCOCC(=O)NC(c1cncc(OC)c1)C1CC(O)C1
InChIInChI=1S/C14H20N2O4/c1-19-8-13(18)16-14(9-3-11(17)4-9)10-5-12(20-2)7-15-6-10/h5-7,9,11,14,17H,3-4,8H2,1-2H3,(H,16,18)
InChIKeyWQAMESJZOAXETQ-UHFFFAOYSA-N
XLogP0.66
TPSA80.68 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 91772492
N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-4-methyl-1,2,5-oxadiazole-3-carboxamide
CID 91775243
3-(benzimidazol-1-yl)-N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]propanamide
CID 91794083
3-hydroxy-N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]pyridine-2-carboxamide
CID 91790438
N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-3-phenyl-1H-pyrazole-5-carboxamide
CID 91787528
2-ethyl-N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-6-oxo-1H-pyridine-4-carboxamide
CID 91764734
N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 91788000
N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-1-(imidazol-1-ylmethyl)cyclopropane-1-carboxamide
CID 91765223
2-(4-chlorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide
CID 91760458
2-(2,4-difluorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide
CID 91785366
2-(4-fluorophenoxy)-N-[(3-hydroxycyclobutyl)-(1-methylpyrazol-4-yl)methyl]acetamide
CID 91781314
2-(2-fluorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide
CID 91790696

Frequently Asked Questions

What is the IUPAC name of N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-2-methoxyacetamide?
The IUPAC name of N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-2-methoxyacetamide (CID 91783772) is N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-2-methoxyacetamide.
What is the SMILES notation for N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-2-methoxyacetamide?
The canonical SMILES for N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-2-methoxyacetamide is COCC(=O)NC(c1cncc(OC)c1)C1CC(O)C1.
What is the InChIKey of N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-2-methoxyacetamide?
The InChIKey is WQAMESJZOAXETQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O4/c1-19-8-13(18)16-14(9-3-11(17)4-9)10-5-12(20-2)7-15-6-10/h5-7,9,11,14,17H,3-4,8H2,1-2H3,(H,16,18).
What are the key properties of N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-2-methoxyacetamide?
N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-2-methoxyacetamide has a molecular weight of 280.32 g/mol, XLogP of 0.66, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-hydroxycyclobutyl)-(5-methoxy-3-pyridinyl)methyl]-2-methoxyacetamide is sourced from PubChem (CID 91783772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).