N-[1-(oxan-3-yl)-2-oxo-3-pyridinyl]acetamide

C12H16N2O3 — CID 137450779

IUPACN-[1-(oxan-3-yl)-2-oxo-3-pyridinyl]acetamide
SMILESCC(=O)Nc1cccn(C2CCCOC2)c1=O
InChIInChI=1S/C12H16N2O3/c1-9(15)13-11-5-2-6-14(12(11)16)10-4-3-7-17-8-10/h2,5-6,10H,3-4,7-8H2,1H3,(H,13,15)
InChIKeyQKYUGNDIVVYWJX-UHFFFAOYSA-N
MW236.27 g/mol
LogP1.16
Rot. Bonds2

About N-[1-(oxan-3-yl)-2-oxo-3-pyridinyl]acetamide

N-[1-(oxan-3-yl)-2-oxo-3-pyridinyl]acetamide (PubChem CID 137450779) has the molecular formula C12H16N2O3 and a molecular weight of 236.27 g/mol. Its IUPAC name is N-[1-(oxan-3-yl)-2-oxo-3-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[1-(oxan-3-yl)-2-oxo-3-pyridinyl]acetamide
PubChem CID137450779
Molecular FormulaC12H16N2O3
Molecular Weight236.27 g/mol
Exact Mass236.12
IUPAC NameN-[1-(oxan-3-yl)-2-oxo-3-pyridinyl]acetamide
SMILESCC(=O)Nc1cccn(C2CCCOC2)c1=O
InChIInChI=1S/C12H16N2O3/c1-9(15)13-11-5-2-6-14(12(11)16)10-4-3-7-17-8-10/h2,5-6,10H,3-4,7-8H2,1H3,(H,13,15)
InChIKeyQKYUGNDIVVYWJX-UHFFFAOYSA-N
XLogP1.16
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-methyl-2-oxo-1-pyridinyl)-N-(oxan-4-yl)acetamide
CID 113231581
6-[(3R)-3-cyclopropylmorpholine-4-carbonyl]-1H-pyridin-2-one
CID 129344736
6-[(2R)-2-(3-methoxypropyl)piperidine-1-carbonyl]-1H-pyridin-2-one
CID 164633084
5-fluoro-3-(methylamino)-1-[(3R)-oxan-3-yl]pyridin-2-one
CID 137449457
5-Fluoro-3-(methylamino)-1-(oxan-3-yl)pyridin-2-one
CID 137449459
3-Amino-5-fluoro-1-(oxan-3-yl)pyridin-2-one
CID 137450648
5-Fluoro-1-(oxan-4-yl)-3-(propan-2-ylamino)pyridin-2-one
CID 137457676
5-fluoro-1-[(3S)-oxan-3-yl]-3-(propan-2-ylamino)pyridin-2-one
CID 139373474
5-fluoro-1-[(3R)-oxan-3-yl]-3-(propan-2-ylamino)pyridin-2-one
CID 139383745
5-Fluoro-1-(oxan-3-yl)-3-(propan-2-ylamino)pyridin-2-one
CID 139390394
3-Amino-1-((tetrahydro-2h-pyran-2-yl)methyl)pyridin-2(1h)-one
CID 62101298
3-Amino-1-(oxan-4-yl)-1,2-dihydropyridin-2-one
CID 86277101

Frequently Asked Questions

What is the IUPAC name of N-[1-(oxan-3-yl)-2-oxo-3-pyridinyl]acetamide?
The IUPAC name of N-[1-(oxan-3-yl)-2-oxo-3-pyridinyl]acetamide (CID 137450779) is N-[1-(oxan-3-yl)-2-oxo-3-pyridinyl]acetamide.
What is the SMILES notation for N-[1-(oxan-3-yl)-2-oxo-3-pyridinyl]acetamide?
The canonical SMILES for N-[1-(oxan-3-yl)-2-oxo-3-pyridinyl]acetamide is CC(=O)Nc1cccn(C2CCCOC2)c1=O.
What is the InChIKey of N-[1-(oxan-3-yl)-2-oxo-3-pyridinyl]acetamide?
The InChIKey is QKYUGNDIVVYWJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O3/c1-9(15)13-11-5-2-6-14(12(11)16)10-4-3-7-17-8-10/h2,5-6,10H,3-4,7-8H2,1H3,(H,13,15).
What are the key properties of N-[1-(oxan-3-yl)-2-oxo-3-pyridinyl]acetamide?
N-[1-(oxan-3-yl)-2-oxo-3-pyridinyl]acetamide has a molecular weight of 236.27 g/mol, XLogP of 1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(oxan-3-yl)-2-oxo-3-pyridinyl]acetamide is sourced from PubChem (CID 137450779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).