N-[6-(hydroxymethyl)oxan-3-yl]acetamide

C8H15NO3 — CID 89371393

IUPACN-[6-(hydroxymethyl)oxan-3-yl]acetamide
SMILESCC(=O)NC1CCC(CO)OC1
InChIInChI=1S/C8H15NO3/c1-6(11)9-7-2-3-8(4-10)12-5-7/h7-8,10H,2-5H2,1H3,(H,9,11)
InChIKeyZXGBOPWGPXADPM-UHFFFAOYSA-N
MW173.21 g/mol
LogP-0.34
Rot. Bonds2

About N-[6-(hydroxymethyl)oxan-3-yl]acetamide

N-[6-(hydroxymethyl)oxan-3-yl]acetamide (PubChem CID 89371393) has the molecular formula C8H15NO3 and a molecular weight of 173.21 g/mol. Its IUPAC name is N-[6-(hydroxymethyl)oxan-3-yl]acetamide.

Molecular Properties

Compound NameN-[6-(hydroxymethyl)oxan-3-yl]acetamide
PubChem CID89371393
Molecular FormulaC8H15NO3
Molecular Weight173.21 g/mol
Exact Mass173.11
IUPAC NameN-[6-(hydroxymethyl)oxan-3-yl]acetamide
SMILESCC(=O)NC1CCC(CO)OC1
InChIInChI=1S/C8H15NO3/c1-6(11)9-7-2-3-8(4-10)12-5-7/h7-8,10H,2-5H2,1H3,(H,9,11)
InChIKeyZXGBOPWGPXADPM-UHFFFAOYSA-N
XLogP-0.34
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.21
LogP ≤ 5-0.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[6-(hydroxymethyl)oxan-3-yl]acetamide?
The IUPAC name of N-[6-(hydroxymethyl)oxan-3-yl]acetamide (CID 89371393) is N-[6-(hydroxymethyl)oxan-3-yl]acetamide.
What is the SMILES notation for N-[6-(hydroxymethyl)oxan-3-yl]acetamide?
The canonical SMILES for N-[6-(hydroxymethyl)oxan-3-yl]acetamide is CC(=O)NC1CCC(CO)OC1.
What is the InChIKey of N-[6-(hydroxymethyl)oxan-3-yl]acetamide?
The InChIKey is ZXGBOPWGPXADPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO3/c1-6(11)9-7-2-3-8(4-10)12-5-7/h7-8,10H,2-5H2,1H3,(H,9,11).
What are the key properties of N-[6-(hydroxymethyl)oxan-3-yl]acetamide?
N-[6-(hydroxymethyl)oxan-3-yl]acetamide has a molecular weight of 173.21 g/mol, XLogP of -0.34, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(hydroxymethyl)oxan-3-yl]acetamide is sourced from PubChem (CID 89371393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).