(5-methyl-3-pyridinyl)-(4-propylmorpholin-2-yl)methanone

C14H20N2O2 — CID 113297079

IUPAC(5-methyl-3-pyridinyl)-(4-propylmorpholin-2-yl)methanone
SMILESCCCN1CCOC(C(=O)c2cncc(C)c2)C1
InChIInChI=1S/C14H20N2O2/c1-3-4-16-5-6-18-13(10-16)14(17)12-7-11(2)8-15-9-12/h7-9,13H,3-6,10H2,1-2H3
InChIKeyQASLNVIMESLCMH-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.68
Rot. Bonds4

About (5-methyl-3-pyridinyl)-(4-propylmorpholin-2-yl)methanone

(5-methyl-3-pyridinyl)-(4-propylmorpholin-2-yl)methanone (PubChem CID 113297079) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is (5-methyl-3-pyridinyl)-(4-propylmorpholin-2-yl)methanone.

Molecular Properties

Compound Name(5-methyl-3-pyridinyl)-(4-propylmorpholin-2-yl)methanone
PubChem CID113297079
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name(5-methyl-3-pyridinyl)-(4-propylmorpholin-2-yl)methanone
SMILESCCCN1CCOC(C(=O)c2cncc(C)c2)C1
InChIInChI=1S/C14H20N2O2/c1-3-4-16-5-6-18-13(10-16)14(17)12-7-11(2)8-15-9-12/h7-9,13H,3-6,10H2,1-2H3
InChIKeyQASLNVIMESLCMH-UHFFFAOYSA-N
XLogP1.68
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(4-methylmorpholin-2-yl)-(5-methyl-3-pyridinyl)methanone
CID 115374040
(1-ethylpyrazol-4-yl)-(4-propylmorpholin-2-yl)methanone
CID 79669008
(4-propylmorpholin-2-yl)-(3-propyltriazol-4-yl)methanone
CID 114686036
(3,5-dimethylphenyl)-(4-ethylmorpholin-2-yl)methanone
CID 79667186
(4-tert-butylphenyl)-(4-propylmorpholin-2-yl)methanone
CID 79663285
2-(3,5-dimethylphenyl)-1-(4-propylmorpholin-2-yl)ethanone
CID 79668855
(4-ethylmorpholin-2-yl)-(3-fluoro-5-methylphenyl)methanone
CID 79705374
4-[(5-methyl-3-pyridinyl)methyl]morpholine-2-carboxylic acid
CID 102877444
(4-chloro-1-propylpyrazol-5-yl)-(4-propylmorpholin-2-yl)methanone
CID 114641477
(3-cyclobutylphenyl)-(4-propylmorpholin-2-yl)methanone
CID 114601991
(5-fluoro-3-pyridinyl)-(4-methylmorpholin-2-yl)methanone
CID 79077902
(2,4-difluorophenyl)-(4-propylmorpholin-2-yl)methanone
CID 79669007

Frequently Asked Questions

What is the IUPAC name of (5-methyl-3-pyridinyl)-(4-propylmorpholin-2-yl)methanone?
The IUPAC name of (5-methyl-3-pyridinyl)-(4-propylmorpholin-2-yl)methanone (CID 113297079) is (5-methyl-3-pyridinyl)-(4-propylmorpholin-2-yl)methanone.
What is the SMILES notation for (5-methyl-3-pyridinyl)-(4-propylmorpholin-2-yl)methanone?
The canonical SMILES for (5-methyl-3-pyridinyl)-(4-propylmorpholin-2-yl)methanone is CCCN1CCOC(C(=O)c2cncc(C)c2)C1.
What is the InChIKey of (5-methyl-3-pyridinyl)-(4-propylmorpholin-2-yl)methanone?
The InChIKey is QASLNVIMESLCMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-3-4-16-5-6-18-13(10-16)14(17)12-7-11(2)8-15-9-12/h7-9,13H,3-6,10H2,1-2H3.
What are the key properties of (5-methyl-3-pyridinyl)-(4-propylmorpholin-2-yl)methanone?
(5-methyl-3-pyridinyl)-(4-propylmorpholin-2-yl)methanone has a molecular weight of 248.33 g/mol, XLogP of 1.68, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-3-pyridinyl)-(4-propylmorpholin-2-yl)methanone is sourced from PubChem (CID 113297079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).