N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]pyridine-2-carboxamide

C15H23N3O2 — CID 98718393

IUPACN-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]pyridine-2-carboxamide
SMILESC[C@@H]1CN([C@H](C)CNC(=O)c2ccccn2)C[C@H](C)O1
InChIInChI=1S/C15H23N3O2/c1-11(18-9-12(2)20-13(3)10-18)8-17-15(19)14-6-4-5-7-16-14/h4-7,11-13H,8-10H2,1-3H3,(H,17,19)/t11-,12-,13+/m1/s1
InChIKeyJYJTVVCKFWDMGA-UPJWGTAASA-N
MW277.37 g/mol
LogP1.31
Rot. Bonds4

About N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]pyridine-2-carboxamide

N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]pyridine-2-carboxamide (PubChem CID 98718393) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]pyridine-2-carboxamide
PubChem CID98718393
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]pyridine-2-carboxamide
SMILESC[C@@H]1CN([C@H](C)CNC(=O)c2ccccn2)C[C@H](C)O1
InChIInChI=1S/C15H23N3O2/c1-11(18-9-12(2)20-13(3)10-18)8-17-15(19)14-6-4-5-7-16-14/h4-7,11-13H,8-10H2,1-3H3,(H,17,19)/t11-,12-,13+/m1/s1
InChIKeyJYJTVVCKFWDMGA-UPJWGTAASA-N
XLogP1.31
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Lsn2463359
CID 72551298
N2,N4-Bis(2-methoxyethyl)-2,4-pyridinedicarboxamide
CID 60788
Piperazine carbamate/urea derivative 3
CID 89487899
N-cyclohexyl-1-methylpyrrole-2-carboxamide
CID 24978957
Piperazine-1,4-diylbis(pyridin-2-ylmethanone)
CID 258989
Safironil
CID 65973
N-cyclohexylpyridine-2-carboxamide
CID 10608271
N-methylpyridine-2-carboxamide
CID 12272691
2-((Pyridin-2-yl)formamido)acetic acid
CID 11788622
Diquat metabolite
CID 86209565
N-[2-(1-benzylpiperidin-4-yl)ethyl]pyridine-2-carboxamide dihydrochloride
CID 14783879
N-(4-piperidin-1-ylphenyl)pyridine-2-carboxamide
CID 2408490

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]pyridine-2-carboxamide?
The IUPAC name of N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]pyridine-2-carboxamide (CID 98718393) is N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]pyridine-2-carboxamide?
The canonical SMILES for N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]pyridine-2-carboxamide is C[C@@H]1CN([C@H](C)CNC(=O)c2ccccn2)C[C@H](C)O1.
What is the InChIKey of N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]pyridine-2-carboxamide?
The InChIKey is JYJTVVCKFWDMGA-UPJWGTAASA-N. The full InChI is InChI=1S/C15H23N3O2/c1-11(18-9-12(2)20-13(3)10-18)8-17-15(19)14-6-4-5-7-16-14/h4-7,11-13H,8-10H2,1-3H3,(H,17,19)/t11-,12-,13+/m1/s1.
What are the key properties of N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]pyridine-2-carboxamide?
N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]pyridine-2-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 1.31, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]pyridine-2-carboxamide is sourced from PubChem (CID 98718393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).