N-(oxan-2-yloxy)-2-pyrimidin-5-ylacetamide

C11H15N3O3 — CID 154862278

IUPACN-(oxan-2-yloxy)-2-pyrimidin-5-ylacetamide
SMILESO=C(Cc1cncnc1)NOC1CCCCO1
InChIInChI=1S/C11H15N3O3/c15-10(5-9-6-12-8-13-7-9)14-17-11-3-1-2-4-16-11/h6-8,11H,1-5H2,(H,14,15)
InChIKeyUAOXZGCRIJEVQV-UHFFFAOYSA-N
MW237.26 g/mol
LogP0.59
Rot. Bonds4

About N-(oxan-2-yloxy)-2-pyrimidin-5-ylacetamide

N-(oxan-2-yloxy)-2-pyrimidin-5-ylacetamide (PubChem CID 154862278) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is N-(oxan-2-yloxy)-2-pyrimidin-5-ylacetamide.

Molecular Properties

Compound NameN-(oxan-2-yloxy)-2-pyrimidin-5-ylacetamide
PubChem CID154862278
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC NameN-(oxan-2-yloxy)-2-pyrimidin-5-ylacetamide
SMILESO=C(Cc1cncnc1)NOC1CCCCO1
InChIInChI=1S/C11H15N3O3/c15-10(5-9-6-12-8-13-7-9)14-17-11-3-1-2-4-16-11/h6-8,11H,1-5H2,(H,14,15)
InChIKeyUAOXZGCRIJEVQV-UHFFFAOYSA-N
XLogP0.59
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-(oxan-2-yloxy)-2-pyrimidin-5-ylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-methoxyphenyl)-N-[(2R)-oxan-2-yl]oxyacetamide
CID 94817277
N-[(2S)-oxan-2-yl]oxy-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 94821745
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(2R)-oxan-2-yl]oxyacetamide
CID 94824444
2-[5-methyl-1-(4-methylphenyl)triazol-4-yl]-N-[(2R)-oxan-2-yl]oxyacetamide
CID 97211516
N-(oxan-2-yloxy)hexanamide
CID 142707517
1-methyl-N-[(2S)-oxan-2-yl]oxypyrazole-4-carboxamide
CID 94825511
1-methyl-N-(oxan-2-yloxy)pyrazole-4-carboxamide
CID 51103148
N-(oxan-2-yloxy)cyclopropanecarboxamide
CID 130685295
N-(2,6-difluorophenyl)-N'-(oxan-2-yloxy)butanediamide
CID 126840011
N-(oxan-2-yloxy)hex-5-ynamide
CID 163203741
5-ethyl-N-(oxan-2-yloxy)furan-2-carboxamide
CID 60613092
4-chloro-N-(oxan-2-yloxy)benzamide
CID 51103118

Frequently Asked Questions

What is the IUPAC name of N-(oxan-2-yloxy)-2-pyrimidin-5-ylacetamide?
The IUPAC name of N-(oxan-2-yloxy)-2-pyrimidin-5-ylacetamide (CID 154862278) is N-(oxan-2-yloxy)-2-pyrimidin-5-ylacetamide.
What is the SMILES notation for N-(oxan-2-yloxy)-2-pyrimidin-5-ylacetamide?
The canonical SMILES for N-(oxan-2-yloxy)-2-pyrimidin-5-ylacetamide is O=C(Cc1cncnc1)NOC1CCCCO1.
What is the InChIKey of N-(oxan-2-yloxy)-2-pyrimidin-5-ylacetamide?
The InChIKey is UAOXZGCRIJEVQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O3/c15-10(5-9-6-12-8-13-7-9)14-17-11-3-1-2-4-16-11/h6-8,11H,1-5H2,(H,14,15).
What are the key properties of N-(oxan-2-yloxy)-2-pyrimidin-5-ylacetamide?
N-(oxan-2-yloxy)-2-pyrimidin-5-ylacetamide has a molecular weight of 237.26 g/mol, XLogP of 0.59, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxan-2-yloxy)-2-pyrimidin-5-ylacetamide is sourced from PubChem (CID 154862278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).