(2R,3R)-N-(1,4-dimethyl-6-oxo-3-pyridinyl)-2-methyloxane-3-carboxamide

C14H20N2O3 — CID 129399642

IUPAC(2R,3R)-N-(1,4-dimethyl-6-oxo-3-pyridinyl)-2-methyloxane-3-carboxamide
SMILESCc1cc(=O)n(C)cc1NC(=O)[C@@H]1CCCO[C@@H]1C
InChIInChI=1S/C14H20N2O3/c1-9-7-13(17)16(3)8-12(9)15-14(18)11-5-4-6-19-10(11)2/h7-8,10-11H,4-6H2,1-3H3,(H,15,18)/t10-,11-/m1/s1
InChIKeyGKUYRVJZVDMEII-GHMZBOCLSA-N
MW264.32 g/mol
LogP1.45
Rot. Bonds2

About (2R,3R)-N-(1,4-dimethyl-6-oxo-3-pyridinyl)-2-methyloxane-3-carboxamide

(2R,3R)-N-(1,4-dimethyl-6-oxo-3-pyridinyl)-2-methyloxane-3-carboxamide (PubChem CID 129399642) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is (2R,3R)-N-(1,4-dimethyl-6-oxo-3-pyridinyl)-2-methyloxane-3-carboxamide.

Molecular Properties

Compound Name(2R,3R)-N-(1,4-dimethyl-6-oxo-3-pyridinyl)-2-methyloxane-3-carboxamide
PubChem CID129399642
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name(2R,3R)-N-(1,4-dimethyl-6-oxo-3-pyridinyl)-2-methyloxane-3-carboxamide
SMILESCc1cc(=O)n(C)cc1NC(=O)[C@@H]1CCCO[C@@H]1C
InChIInChI=1S/C14H20N2O3/c1-9-7-13(17)16(3)8-12(9)15-14(18)11-5-4-6-19-10(11)2/h7-8,10-11H,4-6H2,1-3H3,(H,15,18)/t10-,11-/m1/s1
InChIKeyGKUYRVJZVDMEII-GHMZBOCLSA-N
XLogP1.45
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(1,4-dimethyl-6-oxo-3-pyridinyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 120673991
N-(1,4-dimethyl-6-oxo-3-pyridinyl)piperidine-2-carboxamide
CID 119343326
trans-(1S,2S)-N-(1,4-dimethyl-6-oxo-3-pyridinyl)-2-(4-fluorophenyl)cyclopropane-1-carboxamide
CID 96522930
N-(4-cyclopropyl-2-methylpyrimidin-5-yl)-2-methyloxane-3-carboxamide
CID 154755598
(2S,3S)-2-methyl-N-(2-methyl-6-morpholin-4-yl-3-pyridinyl)oxane-3-carboxamide
CID 128977896
2-methyl-N-(5-methyl-2-pyridinyl)oxane-3-carboxamide
CID 128999567
(2S,3S)-N-hydroxy-2-methyloxane-3-carboxamide
CID 130892243
(2R,3R)-2-ethyl-N-(1-methyl-6-oxo-3-pyridinyl)oxane-3-carboxamide
CID 129479241
(2S,3S)-N-[1-(2-fluorophenyl)-5-methylpyrazol-4-yl]-2-methyloxane-3-carboxamide
CID 129400162
(2S,3S)-N-[1,4-dimethyl-3-(trifluoromethyl)pyrazol-5-yl]-2-methyloxane-3-carboxamide
CID 128987788
2-methyl-N-(5-methyl-1H-1,2,4-triazol-3-yl)oxane-3-carboxamide
CID 154735472
N-(2-amino-4-methylphenyl)-2-methyloxolane-3-carboxamide
CID 79750828

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-N-(1,4-dimethyl-6-oxo-3-pyridinyl)-2-methyloxane-3-carboxamide?
The IUPAC name of (2R,3R)-N-(1,4-dimethyl-6-oxo-3-pyridinyl)-2-methyloxane-3-carboxamide (CID 129399642) is (2R,3R)-N-(1,4-dimethyl-6-oxo-3-pyridinyl)-2-methyloxane-3-carboxamide.
What is the SMILES notation for (2R,3R)-N-(1,4-dimethyl-6-oxo-3-pyridinyl)-2-methyloxane-3-carboxamide?
The canonical SMILES for (2R,3R)-N-(1,4-dimethyl-6-oxo-3-pyridinyl)-2-methyloxane-3-carboxamide is Cc1cc(=O)n(C)cc1NC(=O)[C@@H]1CCCO[C@@H]1C.
What is the InChIKey of (2R,3R)-N-(1,4-dimethyl-6-oxo-3-pyridinyl)-2-methyloxane-3-carboxamide?
The InChIKey is GKUYRVJZVDMEII-GHMZBOCLSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-9-7-13(17)16(3)8-12(9)15-14(18)11-5-4-6-19-10(11)2/h7-8,10-11H,4-6H2,1-3H3,(H,15,18)/t10-,11-/m1/s1.
What are the key properties of (2R,3R)-N-(1,4-dimethyl-6-oxo-3-pyridinyl)-2-methyloxane-3-carboxamide?
(2R,3R)-N-(1,4-dimethyl-6-oxo-3-pyridinyl)-2-methyloxane-3-carboxamide has a molecular weight of 264.32 g/mol, XLogP of 1.45, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-N-(1,4-dimethyl-6-oxo-3-pyridinyl)-2-methyloxane-3-carboxamide is sourced from PubChem (CID 129399642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).