(3-methyl-2H-pyridin-1-yl)-morpholin-2-ylmethanone

C11H16N2O2 — CID 174546605

IUPAC(3-methyl-2H-pyridin-1-yl)-morpholin-2-ylmethanone
SMILESCC1=CC=CN(C(=O)C2CNCCO2)C1
InChIInChI=1S/C11H16N2O2/c1-9-3-2-5-13(8-9)11(14)10-7-12-4-6-15-10/h2-3,5,10,12H,4,6-8H2,1H3
InChIKeyAGEQDINTEOQKPC-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.28
Rot. Bonds1

About (3-methyl-2H-pyridin-1-yl)-morpholin-2-ylmethanone

(3-methyl-2H-pyridin-1-yl)-morpholin-2-ylmethanone (PubChem CID 174546605) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is (3-methyl-2H-pyridin-1-yl)-morpholin-2-ylmethanone.

Molecular Properties

Compound Name(3-methyl-2H-pyridin-1-yl)-morpholin-2-ylmethanone
PubChem CID174546605
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name(3-methyl-2H-pyridin-1-yl)-morpholin-2-ylmethanone
SMILESCC1=CC=CN(C(=O)C2CNCCO2)C1
InChIInChI=1S/C11H16N2O2/c1-9-3-2-5-13(8-9)11(14)10-7-12-4-6-15-10/h2-3,5,10,12H,4,6-8H2,1H3
InChIKeyAGEQDINTEOQKPC-UHFFFAOYSA-N
XLogP0.28
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3-methyl-2H-pyridin-1-yl)-morpholin-2-ylmethanone?
The IUPAC name of (3-methyl-2H-pyridin-1-yl)-morpholin-2-ylmethanone (CID 174546605) is (3-methyl-2H-pyridin-1-yl)-morpholin-2-ylmethanone.
What is the SMILES notation for (3-methyl-2H-pyridin-1-yl)-morpholin-2-ylmethanone?
The canonical SMILES for (3-methyl-2H-pyridin-1-yl)-morpholin-2-ylmethanone is CC1=CC=CN(C(=O)C2CNCCO2)C1.
What is the InChIKey of (3-methyl-2H-pyridin-1-yl)-morpholin-2-ylmethanone?
The InChIKey is AGEQDINTEOQKPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-9-3-2-5-13(8-9)11(14)10-7-12-4-6-15-10/h2-3,5,10,12H,4,6-8H2,1H3.
What are the key properties of (3-methyl-2H-pyridin-1-yl)-morpholin-2-ylmethanone?
(3-methyl-2H-pyridin-1-yl)-morpholin-2-ylmethanone has a molecular weight of 208.26 g/mol, XLogP of 0.28, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methyl-2H-pyridin-1-yl)-morpholin-2-ylmethanone is sourced from PubChem (CID 174546605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).