(6R)-6-methyl-4-(3-methylpyridine-2-carbonyl)morpholine-2-carboxylic acid

C13H16N2O4 — CID 120536159

IUPAC(6R)-6-methyl-4-(3-methylpyridine-2-carbonyl)morpholine-2-carboxylic acid
SMILESCc1cccnc1C(=O)N1CC(C(=O)O)O[C@H](C)C1
InChIInChI=1S/C13H16N2O4/c1-8-4-3-5-14-11(8)12(16)15-6-9(2)19-10(7-15)13(17)18/h3-5,9-10H,6-7H2,1-2H3,(H,17,18)/t9-,10?/m1/s1
InChIKeyHWATYTDZQKBTLZ-YHMJZVADSA-N
MW264.28 g/mol
LogP0.70
Rot. Bonds2

About (6R)-6-methyl-4-(3-methylpyridine-2-carbonyl)morpholine-2-carboxylic acid

(6R)-6-methyl-4-(3-methylpyridine-2-carbonyl)morpholine-2-carboxylic acid (PubChem CID 120536159) has the molecular formula C13H16N2O4 and a molecular weight of 264.28 g/mol. Its IUPAC name is (6R)-6-methyl-4-(3-methylpyridine-2-carbonyl)morpholine-2-carboxylic acid.

Molecular Properties

Compound Name(6R)-6-methyl-4-(3-methylpyridine-2-carbonyl)morpholine-2-carboxylic acid
PubChem CID120536159
Molecular FormulaC13H16N2O4
Molecular Weight264.28 g/mol
Exact Mass264.11
IUPAC Name(6R)-6-methyl-4-(3-methylpyridine-2-carbonyl)morpholine-2-carboxylic acid
SMILESCc1cccnc1C(=O)N1CC(C(=O)O)O[C@H](C)C1
InChIInChI=1S/C13H16N2O4/c1-8-4-3-5-14-11(8)12(16)15-6-9(2)19-10(7-15)13(17)18/h3-5,9-10H,6-7H2,1-2H3,(H,17,18)/t9-,10?/m1/s1
InChIKeyHWATYTDZQKBTLZ-YHMJZVADSA-N
XLogP0.70
TPSA79.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-1-(3-methylpyridine-2-carbonyl)piperidine-3-carboxylic acid
CID 122117858
(3-hydroxyazetidin-1-yl)-(3-methyl-2-pyridinyl)methanone
CID 63106422
(6R)-4-(2-chloro-3-methylbenzoyl)-6-methylmorpholine-2-carboxylic acid
CID 120536036
(3-tert-butyl-2-pyridinyl)-(2,6-dimethylmorpholin-4-yl)methanone
CID 89458475
(6R)-4-(2,5-dimethyl-1,3-thiazole-4-carbonyl)-6-methylmorpholine-2-carboxylic acid
CID 120536127
[(2S,6R)-2-cyclopropyl-6-phenylmorpholin-4-yl]-(3-methyl-2-pyridinyl)methanone
CID 134700307
[(3R)-3-hydroxypyrrolidin-1-yl]-(3-methyl-2-pyridinyl)methanone
CID 66291772
3-methyl-1-(3-methylpyridine-2-carbonyl)piperidin-4-one
CID 114499935
(6R)-6-methyl-4-(2-phenylmethoxypyridine-4-carbonyl)morpholine-2-carboxylic acid
CID 120536224
(3-aminopyrrolidin-1-yl)-(3-methyl-2-pyridinyl)methanone;dihydrochloride
CID 119482706
(2,6-dimethylmorpholin-4-yl)-(2-pyrrolidin-1-yl-3-pyridinyl)methanone
CID 134016503
(6R)-6-methyl-4-[3-[(6-methyl-3-pyridinyl)oxymethyl]benzoyl]morpholine-2-carboxylic acid
CID 120536231

Frequently Asked Questions

What is the IUPAC name of (6R)-6-methyl-4-(3-methylpyridine-2-carbonyl)morpholine-2-carboxylic acid?
The IUPAC name of (6R)-6-methyl-4-(3-methylpyridine-2-carbonyl)morpholine-2-carboxylic acid (CID 120536159) is (6R)-6-methyl-4-(3-methylpyridine-2-carbonyl)morpholine-2-carboxylic acid.
What is the SMILES notation for (6R)-6-methyl-4-(3-methylpyridine-2-carbonyl)morpholine-2-carboxylic acid?
The canonical SMILES for (6R)-6-methyl-4-(3-methylpyridine-2-carbonyl)morpholine-2-carboxylic acid is Cc1cccnc1C(=O)N1CC(C(=O)O)O[C@H](C)C1.
What is the InChIKey of (6R)-6-methyl-4-(3-methylpyridine-2-carbonyl)morpholine-2-carboxylic acid?
The InChIKey is HWATYTDZQKBTLZ-YHMJZVADSA-N. The full InChI is InChI=1S/C13H16N2O4/c1-8-4-3-5-14-11(8)12(16)15-6-9(2)19-10(7-15)13(17)18/h3-5,9-10H,6-7H2,1-2H3,(H,17,18)/t9-,10?/m1/s1.
What are the key properties of (6R)-6-methyl-4-(3-methylpyridine-2-carbonyl)morpholine-2-carboxylic acid?
(6R)-6-methyl-4-(3-methylpyridine-2-carbonyl)morpholine-2-carboxylic acid has a molecular weight of 264.28 g/mol, XLogP of 0.70, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-6-methyl-4-(3-methylpyridine-2-carbonyl)morpholine-2-carboxylic acid is sourced from PubChem (CID 120536159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).