2-methyl-N-(5-methyl-2-pyridinyl)oxane-3-carboxamide

C13H18N2O2 — CID 128999567

IUPAC2-methyl-N-(5-methyl-2-pyridinyl)oxane-3-carboxamide
SMILESCc1ccc(NC(=O)C2CCCOC2C)nc1
InChIInChI=1S/C13H18N2O2/c1-9-5-6-12(14-8-9)15-13(16)11-4-3-7-17-10(11)2/h5-6,8,10-11H,3-4,7H2,1-2H3,(H,14,15,16)
InChIKeyDPDCGDAVWLLTNS-UHFFFAOYSA-N
MW234.30 g/mol
LogP2.14
Rot. Bonds2

About 2-methyl-N-(5-methyl-2-pyridinyl)oxane-3-carboxamide

2-methyl-N-(5-methyl-2-pyridinyl)oxane-3-carboxamide (PubChem CID 128999567) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-methyl-N-(5-methyl-2-pyridinyl)oxane-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(5-methyl-2-pyridinyl)oxane-3-carboxamide
PubChem CID128999567
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name2-methyl-N-(5-methyl-2-pyridinyl)oxane-3-carboxamide
SMILESCc1ccc(NC(=O)C2CCCOC2C)nc1
InChIInChI=1S/C13H18N2O2/c1-9-5-6-12(14-8-9)15-13(16)11-4-3-7-17-10(11)2/h5-6,8,10-11H,3-4,7H2,1-2H3,(H,14,15,16)
InChIKeyDPDCGDAVWLLTNS-UHFFFAOYSA-N
XLogP2.14
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-(dimethylamino)-2-pyridinyl]-2-methyloxane-3-carboxamide
CID 129000728
(2S,3S)-N-[5-(dimethylamino)-2-pyridinyl]-2-methyloxane-3-carboxamide
CID 129400783
3,4-dimethyl-6-[(5-methyl-2-pyridinyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 6467718
N-(4-cyclopropyl-2-methylpyrimidin-5-yl)-2-methyloxane-3-carboxamide
CID 154755598
(1R,2R,4R)-N-(5-methyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 98280304
(1R,2R,4S)-N-(5-methyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 40530150
trans-(1S,3S)-3-methyl-N-(5-methyl-2-pyridinyl)cyclopentane-1-carboxamide
CID 58763333
5-methyl-N-(2-methyloxolan-3-yl)pyridin-2-amine
CID 82728713
(2S,3R)-2-methyl-N-[(6-methyl-3-pyridinyl)methyl]oxane-3-carboxamide
CID 129349546
(2S,3S)-2-methyl-N-[(6-methyl-3-pyridinyl)methyl]oxane-3-carboxamide
CID 129349544
(2S,3R)-2-methyl-N-(5-methyl-2-pyridinyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 30008387
(2S,3S)-2-methyl-N-(5-methyl-2-pyridinyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 30008379

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(5-methyl-2-pyridinyl)oxane-3-carboxamide?
The IUPAC name of 2-methyl-N-(5-methyl-2-pyridinyl)oxane-3-carboxamide (CID 128999567) is 2-methyl-N-(5-methyl-2-pyridinyl)oxane-3-carboxamide.
What is the SMILES notation for 2-methyl-N-(5-methyl-2-pyridinyl)oxane-3-carboxamide?
The canonical SMILES for 2-methyl-N-(5-methyl-2-pyridinyl)oxane-3-carboxamide is Cc1ccc(NC(=O)C2CCCOC2C)nc1.
What is the InChIKey of 2-methyl-N-(5-methyl-2-pyridinyl)oxane-3-carboxamide?
The InChIKey is DPDCGDAVWLLTNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-9-5-6-12(14-8-9)15-13(16)11-4-3-7-17-10(11)2/h5-6,8,10-11H,3-4,7H2,1-2H3,(H,14,15,16).
What are the key properties of 2-methyl-N-(5-methyl-2-pyridinyl)oxane-3-carboxamide?
2-methyl-N-(5-methyl-2-pyridinyl)oxane-3-carboxamide has a molecular weight of 234.30 g/mol, XLogP of 2.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(5-methyl-2-pyridinyl)oxane-3-carboxamide is sourced from PubChem (CID 128999567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).