2,6-dimethyl-4-morpholin-4-ylpyridine-3-carboxamide

C12H17N3O2 — CID 15501239

IUPAC2,6-dimethyl-4-morpholin-4-ylpyridine-3-carboxamide
SMILESCc1cc(N2CCOCC2)c(C(N)=O)c(C)n1
InChIInChI=1S/C12H17N3O2/c1-8-7-10(15-3-5-17-6-4-15)11(12(13)16)9(2)14-8/h7H,3-6H2,1-2H3,(H2,13,16)
InChIKeyJLNUOGBYZHHLIX-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.63
Rot. Bonds2

About 2,6-dimethyl-4-morpholin-4-ylpyridine-3-carboxamide

2,6-dimethyl-4-morpholin-4-ylpyridine-3-carboxamide (PubChem CID 15501239) has the molecular formula C12H17N3O2 and a molecular weight of 235.29 g/mol. Its IUPAC name is 2,6-dimethyl-4-morpholin-4-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name2,6-dimethyl-4-morpholin-4-ylpyridine-3-carboxamide
PubChem CID15501239
Molecular FormulaC12H17N3O2
Molecular Weight235.29 g/mol
Exact Mass235.13
IUPAC Name2,6-dimethyl-4-morpholin-4-ylpyridine-3-carboxamide
SMILESCc1cc(N2CCOCC2)c(C(N)=O)c(C)n1
InChIInChI=1S/C12H17N3O2/c1-8-7-10(15-3-5-17-6-4-15)11(12(13)16)9(2)14-8/h7H,3-6H2,1-2H3,(H2,13,16)
InChIKeyJLNUOGBYZHHLIX-UHFFFAOYSA-N
XLogP0.63
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-morpholin-4-ylpyridine-3-carboxamide?
The IUPAC name of 2,6-dimethyl-4-morpholin-4-ylpyridine-3-carboxamide (CID 15501239) is 2,6-dimethyl-4-morpholin-4-ylpyridine-3-carboxamide.
What is the SMILES notation for 2,6-dimethyl-4-morpholin-4-ylpyridine-3-carboxamide?
The canonical SMILES for 2,6-dimethyl-4-morpholin-4-ylpyridine-3-carboxamide is Cc1cc(N2CCOCC2)c(C(N)=O)c(C)n1.
What is the InChIKey of 2,6-dimethyl-4-morpholin-4-ylpyridine-3-carboxamide?
The InChIKey is JLNUOGBYZHHLIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2/c1-8-7-10(15-3-5-17-6-4-15)11(12(13)16)9(2)14-8/h7H,3-6H2,1-2H3,(H2,13,16).
What are the key properties of 2,6-dimethyl-4-morpholin-4-ylpyridine-3-carboxamide?
2,6-dimethyl-4-morpholin-4-ylpyridine-3-carboxamide has a molecular weight of 235.29 g/mol, XLogP of 0.63, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-morpholin-4-ylpyridine-3-carboxamide is sourced from PubChem (CID 15501239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).