N-[5-[2-(oxan-4-yl)-1,3-oxazol-5-yl]-2-pyridinyl]acetamide

C15H17N3O3 — CID 136570446

IUPACN-[5-[2-(oxan-4-yl)-1,3-oxazol-5-yl]-2-pyridinyl]acetamide
SMILESCC(=O)Nc1ccc(-c2cnc(C3CCOCC3)o2)cn1
InChIInChI=1S/C15H17N3O3/c1-10(19)18-14-3-2-12(8-16-14)13-9-17-15(21-13)11-4-6-20-7-5-11/h2-3,8-9,11H,4-7H2,1H3,(H,16,18,19)
InChIKeyQRMVFCSMLZBNNC-UHFFFAOYSA-N
MW287.32 g/mol
LogP2.59
Rot. Bonds3

About N-[5-[2-(oxan-4-yl)-1,3-oxazol-5-yl]-2-pyridinyl]acetamide

N-[5-[2-(oxan-4-yl)-1,3-oxazol-5-yl]-2-pyridinyl]acetamide (PubChem CID 136570446) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is N-[5-[2-(oxan-4-yl)-1,3-oxazol-5-yl]-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[5-[2-(oxan-4-yl)-1,3-oxazol-5-yl]-2-pyridinyl]acetamide
PubChem CID136570446
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC NameN-[5-[2-(oxan-4-yl)-1,3-oxazol-5-yl]-2-pyridinyl]acetamide
SMILESCC(=O)Nc1ccc(-c2cnc(C3CCOCC3)o2)cn1
InChIInChI=1S/C15H17N3O3/c1-10(19)18-14-3-2-12(8-16-14)13-9-17-15(21-13)11-4-6-20-7-5-11/h2-3,8-9,11H,4-7H2,1H3,(H,16,18,19)
InChIKeyQRMVFCSMLZBNNC-UHFFFAOYSA-N
XLogP2.59
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[5-[2-(oxan-4-yl)-1,3-oxazol-5-yl]-2-pyridinyl]acetamide?
The IUPAC name of N-[5-[2-(oxan-4-yl)-1,3-oxazol-5-yl]-2-pyridinyl]acetamide (CID 136570446) is N-[5-[2-(oxan-4-yl)-1,3-oxazol-5-yl]-2-pyridinyl]acetamide.
What is the SMILES notation for N-[5-[2-(oxan-4-yl)-1,3-oxazol-5-yl]-2-pyridinyl]acetamide?
The canonical SMILES for N-[5-[2-(oxan-4-yl)-1,3-oxazol-5-yl]-2-pyridinyl]acetamide is CC(=O)Nc1ccc(-c2cnc(C3CCOCC3)o2)cn1.
What is the InChIKey of N-[5-[2-(oxan-4-yl)-1,3-oxazol-5-yl]-2-pyridinyl]acetamide?
The InChIKey is QRMVFCSMLZBNNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-10(19)18-14-3-2-12(8-16-14)13-9-17-15(21-13)11-4-6-20-7-5-11/h2-3,8-9,11H,4-7H2,1H3,(H,16,18,19).
What are the key properties of N-[5-[2-(oxan-4-yl)-1,3-oxazol-5-yl]-2-pyridinyl]acetamide?
N-[5-[2-(oxan-4-yl)-1,3-oxazol-5-yl]-2-pyridinyl]acetamide has a molecular weight of 287.32 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[2-(oxan-4-yl)-1,3-oxazol-5-yl]-2-pyridinyl]acetamide is sourced from PubChem (CID 136570446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).