3-morpholin-4-yl-1H-pyridin-2-one

C9H12N2O2 — CID 68885060

IUPAC3-morpholin-4-yl-1H-pyridin-2-one
SMILESO=c1[nH]cccc1N1CCOCC1
InChIInChI=1S/C9H12N2O2/c12-9-8(2-1-3-10-9)11-4-6-13-7-5-11/h1-3H,4-7H2,(H,10,12)
InChIKeyNMVVTUFCOTZTMF-UHFFFAOYSA-N
MW180.21 g/mol
LogP0.21
Rot. Bonds1

About 3-morpholin-4-yl-1H-pyridin-2-one

3-morpholin-4-yl-1H-pyridin-2-one (PubChem CID 68885060) has the molecular formula C9H12N2O2 and a molecular weight of 180.21 g/mol. Its IUPAC name is 3-morpholin-4-yl-1H-pyridin-2-one.

Molecular Properties

Compound Name3-morpholin-4-yl-1H-pyridin-2-one
PubChem CID68885060
Molecular FormulaC9H12N2O2
Molecular Weight180.21 g/mol
Exact Mass180.09
IUPAC Name3-morpholin-4-yl-1H-pyridin-2-one
SMILESO=c1[nH]cccc1N1CCOCC1
InChIInChI=1S/C9H12N2O2/c12-9-8(2-1-3-10-9)11-4-6-13-7-5-11/h1-3H,4-7H2,(H,10,12)
InChIKeyNMVVTUFCOTZTMF-UHFFFAOYSA-N
XLogP0.21
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-morpholin-4-yl-1H-pyridin-2-one?
The IUPAC name of 3-morpholin-4-yl-1H-pyridin-2-one (CID 68885060) is 3-morpholin-4-yl-1H-pyridin-2-one.
What is the SMILES notation for 3-morpholin-4-yl-1H-pyridin-2-one?
The canonical SMILES for 3-morpholin-4-yl-1H-pyridin-2-one is O=c1[nH]cccc1N1CCOCC1.
What is the InChIKey of 3-morpholin-4-yl-1H-pyridin-2-one?
The InChIKey is NMVVTUFCOTZTMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O2/c12-9-8(2-1-3-10-9)11-4-6-13-7-5-11/h1-3H,4-7H2,(H,10,12).
What are the key properties of 3-morpholin-4-yl-1H-pyridin-2-one?
3-morpholin-4-yl-1H-pyridin-2-one has a molecular weight of 180.21 g/mol, XLogP of 0.21, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-morpholin-4-yl-1H-pyridin-2-one is sourced from PubChem (CID 68885060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).