N-[6-(oxolan-3-yloxymethyl)-2-pyridinyl]acetamide

C12H16N2O3 — CID 154658060

IUPACN-[6-(oxolan-3-yloxymethyl)-2-pyridinyl]acetamide
SMILESCC(=O)Nc1cccc(COC2CCOC2)n1
InChIInChI=1S/C12H16N2O3/c1-9(15)13-12-4-2-3-10(14-12)7-17-11-5-6-16-8-11/h2-4,11H,5-8H2,1H3,(H,13,14,15)
InChIKeyLEGDQLIFZJQOCH-UHFFFAOYSA-N
MW236.27 g/mol
LogP1.35
Rot. Bonds4

About N-[6-(oxolan-3-yloxymethyl)-2-pyridinyl]acetamide

N-[6-(oxolan-3-yloxymethyl)-2-pyridinyl]acetamide (PubChem CID 154658060) has the molecular formula C12H16N2O3 and a molecular weight of 236.27 g/mol. Its IUPAC name is N-[6-(oxolan-3-yloxymethyl)-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[6-(oxolan-3-yloxymethyl)-2-pyridinyl]acetamide
PubChem CID154658060
Molecular FormulaC12H16N2O3
Molecular Weight236.27 g/mol
Exact Mass236.12
IUPAC NameN-[6-(oxolan-3-yloxymethyl)-2-pyridinyl]acetamide
SMILESCC(=O)Nc1cccc(COC2CCOC2)n1
InChIInChI=1S/C12H16N2O3/c1-9(15)13-12-4-2-3-10(14-12)7-17-11-5-6-16-8-11/h2-4,11H,5-8H2,1H3,(H,13,14,15)
InChIKeyLEGDQLIFZJQOCH-UHFFFAOYSA-N
XLogP1.35
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl N-[[6-[[(3S)-oxolan-3-yl]oxymethyl]-2-pyridinyl]methyl]carbamate
CID 140925195
2-bromo-6-[[(3R)-oxolan-3-yl]oxymethyl]pyridine
CID 154377158
2-methyl-N-[[6-(oxolan-3-yloxymethyl)-2-pyridinyl]methyl]propan-2-amine
CID 106908333
6-(oxolan-3-yloxymethyl)pyridine-2-carbonitrile
CID 66718550
6-(oxan-4-yloxymethyl)pyridine-2-carboxylic acid
CID 106903338
[6-(2-methylbutoxymethyl)-2-pyridinyl]methanamine;[6-(oxolan-3-yloxymethyl)-2-pyridinyl]methanamine
CID 145133902
2-chloro-6-(oxan-4-yloxymethyl)pyridine
CID 79243769
6-(cyclohexyloxymethyl)-N-methylpyridin-2-amine
CID 79239011
N-[[2-(oxolan-3-yloxymethyl)phenyl]methyl]ethanamine
CID 63557703
[4-[[(3S)-oxolan-3-yl]oxymethyl]pyrimidin-2-yl]methanamine
CID 142707797
N-[[6-(oxan-4-yloxymethyl)-2-pyridinyl]methyl]propan-1-amine
CID 106907547
2-tert-butyl-6-(2-propan-2-yloxyethyl)pyridine;N-[2-(6-tert-butyl-2-pyridinyl)ethyl]propan-2-amine;N-[1-[6-(2-hydroxypropan-2-yl)-2-pyridinyl]ethyl]-2-methylpropanamide;N-[[6-(2-hydroxypropan-2-yl)-2-pyridinyl]methyl]-2-methylpropanamide;2-methyl-N-[6-(oxolan-3-yloxymethyl)-2-pyridinyl]propanamide;2-(oxolan-3-yloxymethyl)-6-(2-propan-2-yloxyethyl)pyridine;2-(oxolan-3-yloxymethyl)-6-(propan-2-yloxymethyl)pyridine;N-[[6-(oxolan-3-yloxymethyl)-2-pyridinyl]methyl]propan-2-amine;2-[6-[(propan-2-ylamino)methyl]-2-pyridinyl]propan-2-ol;2-[6-(propan-2-yloxymethyl)-2-pyridinyl]propan-2-ol
CID 165109198

Frequently Asked Questions

What is the IUPAC name of N-[6-(oxolan-3-yloxymethyl)-2-pyridinyl]acetamide?
The IUPAC name of N-[6-(oxolan-3-yloxymethyl)-2-pyridinyl]acetamide (CID 154658060) is N-[6-(oxolan-3-yloxymethyl)-2-pyridinyl]acetamide.
What is the SMILES notation for N-[6-(oxolan-3-yloxymethyl)-2-pyridinyl]acetamide?
The canonical SMILES for N-[6-(oxolan-3-yloxymethyl)-2-pyridinyl]acetamide is CC(=O)Nc1cccc(COC2CCOC2)n1.
What is the InChIKey of N-[6-(oxolan-3-yloxymethyl)-2-pyridinyl]acetamide?
The InChIKey is LEGDQLIFZJQOCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O3/c1-9(15)13-12-4-2-3-10(14-12)7-17-11-5-6-16-8-11/h2-4,11H,5-8H2,1H3,(H,13,14,15).
What are the key properties of N-[6-(oxolan-3-yloxymethyl)-2-pyridinyl]acetamide?
N-[6-(oxolan-3-yloxymethyl)-2-pyridinyl]acetamide has a molecular weight of 236.27 g/mol, XLogP of 1.35, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(oxolan-3-yloxymethyl)-2-pyridinyl]acetamide is sourced from PubChem (CID 154658060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).