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

C15H23N3O2 — CID 42958335

IUPACN-[2-(2,6-dimethylmorpholin-4-yl)propyl]pyridine-4-carboxamide
SMILESCC1CN(C(C)CNC(=O)c2ccncc2)CC(C)O1
InChIInChI=1S/C15H23N3O2/c1-11(18-9-12(2)20-13(3)10-18)8-17-15(19)14-4-6-16-7-5-14/h4-7,11-13H,8-10H2,1-3H3,(H,17,19)
InChIKeyWODQYHYTFPFLAD-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.31
Rot. Bonds4

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

N-[2-(2,6-dimethylmorpholin-4-yl)propyl]pyridine-4-carboxamide (PubChem CID 42958335) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-[2-(2,6-dimethylmorpholin-4-yl)propyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(2,6-dimethylmorpholin-4-yl)propyl]pyridine-4-carboxamide
PubChem CID42958335
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-[2-(2,6-dimethylmorpholin-4-yl)propyl]pyridine-4-carboxamide
SMILESCC1CN(C(C)CNC(=O)c2ccncc2)CC(C)O1
InChIInChI=1S/C15H23N3O2/c1-11(18-9-12(2)20-13(3)10-18)8-17-15(19)14-4-6-16-7-5-14/h4-7,11-13H,8-10H2,1-3H3,(H,17,19)
InChIKeyWODQYHYTFPFLAD-UHFFFAOYSA-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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Frequently Asked Questions

What is the IUPAC name of N-[2-(2,6-dimethylmorpholin-4-yl)propyl]pyridine-4-carboxamide?
The IUPAC name of N-[2-(2,6-dimethylmorpholin-4-yl)propyl]pyridine-4-carboxamide (CID 42958335) is N-[2-(2,6-dimethylmorpholin-4-yl)propyl]pyridine-4-carboxamide.
What is the SMILES notation for N-[2-(2,6-dimethylmorpholin-4-yl)propyl]pyridine-4-carboxamide?
The canonical SMILES for N-[2-(2,6-dimethylmorpholin-4-yl)propyl]pyridine-4-carboxamide is CC1CN(C(C)CNC(=O)c2ccncc2)CC(C)O1.
What is the InChIKey of N-[2-(2,6-dimethylmorpholin-4-yl)propyl]pyridine-4-carboxamide?
The InChIKey is WODQYHYTFPFLAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-11(18-9-12(2)20-13(3)10-18)8-17-15(19)14-4-6-16-7-5-14/h4-7,11-13H,8-10H2,1-3H3,(H,17,19).
What are the key properties of N-[2-(2,6-dimethylmorpholin-4-yl)propyl]pyridine-4-carboxamide?
N-[2-(2,6-dimethylmorpholin-4-yl)propyl]pyridine-4-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-[2-(2,6-dimethylmorpholin-4-yl)propyl]pyridine-4-carboxamide is sourced from PubChem (CID 42958335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).