3-amino-1-(oxan-4-yl)pyridin-2-one

C10H14N2O2 — CID 86277101

IUPAC3-amino-1-(oxan-4-yl)pyridin-2-one
SMILESNc1cccn(C2CCOCC2)c1=O
InChIInChI=1S/C10H14N2O2/c11-9-2-1-5-12(10(9)13)8-3-6-14-7-4-8/h1-2,5,8H,3-4,6-7,11H2
InChIKeyHZFSTMTUCZQZGA-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.78
Rot. Bonds1

About 3-amino-1-(oxan-4-yl)pyridin-2-one

3-amino-1-(oxan-4-yl)pyridin-2-one (PubChem CID 86277101) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 3-amino-1-(oxan-4-yl)pyridin-2-one.

Molecular Properties

Compound Name3-amino-1-(oxan-4-yl)pyridin-2-one
PubChem CID86277101
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name3-amino-1-(oxan-4-yl)pyridin-2-one
SMILESNc1cccn(C2CCOCC2)c1=O
InChIInChI=1S/C10H14N2O2/c11-9-2-1-5-12(10(9)13)8-3-6-14-7-4-8/h1-2,5,8H,3-4,6-7,11H2
InChIKeyHZFSTMTUCZQZGA-UHFFFAOYSA-N
XLogP0.78
TPSA57.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.78
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
5-Fluoro-3-(methylamino)-1-(oxan-4-yl)pyridin-2-one
CID 137449461
3-Amino-5-fluoro-1-(oxan-3-yl)pyridin-2-one
CID 137450648
3-Amino-5-fluoro-1-(oxan-4-yl)pyridin-2-one
CID 137450858
5-Fluoro-1-(oxan-4-yl)-3-(propan-2-ylamino)pyridin-2-one
CID 137457676
3-Amino-1-(oxan-4-yl)-5-(trifluoromethyl)pyridin-2-one
CID 167134417
3-Amino-1-[3-(2,2,2-trifluoroethoxy)propyl]pyridin-2-one
CID 62100972
1-[2-(Oxan-4-ylamino)ethyl]-6-(trifluoromethyl)pyridin-2-one
CID 81320215
2-(5-fluoro-2-oxo-1-pyridinyl)-N-(oxan-4-yl)acetamide
CID 132381514
3-Amino-1-(3-methoxypropyl)pyridin-2(1h)-one
CID 62101795
1-(Oxan-4-yl)pyridin-2-one
CID 84409471
3-Amino-1-(oxolan-3-yl)-1,2-dihydropyridin-2-one
CID 118155372

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(oxan-4-yl)pyridin-2-one?
The IUPAC name of 3-amino-1-(oxan-4-yl)pyridin-2-one (CID 86277101) is 3-amino-1-(oxan-4-yl)pyridin-2-one.
What is the SMILES notation for 3-amino-1-(oxan-4-yl)pyridin-2-one?
The canonical SMILES for 3-amino-1-(oxan-4-yl)pyridin-2-one is Nc1cccn(C2CCOCC2)c1=O.
What is the InChIKey of 3-amino-1-(oxan-4-yl)pyridin-2-one?
The InChIKey is HZFSTMTUCZQZGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c11-9-2-1-5-12(10(9)13)8-3-6-14-7-4-8/h1-2,5,8H,3-4,6-7,11H2.
What are the key properties of 3-amino-1-(oxan-4-yl)pyridin-2-one?
3-amino-1-(oxan-4-yl)pyridin-2-one has a molecular weight of 194.23 g/mol, XLogP of 0.78, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(oxan-4-yl)pyridin-2-one is sourced from PubChem (CID 86277101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).