6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide

C19H24N4O2 — CID 39898275

IUPAC6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide
SMILESC[C@@H]1CN(c2ccc(C(=O)NCCc3ccccn3)cn2)C[C@@H](C)O1
InChIInChI=1S/C19H24N4O2/c1-14-12-23(13-15(2)25-14)18-7-6-16(11-22-18)19(24)21-10-8-17-5-3-4-9-20-17/h3-7,9,11,14-15H,8,10,12-13H2,1-2H3,(H,21,24)/t14-,15-/m1/s1
InChIKeyHKZJQONRZOMROU-HUUCEWRRSA-N
MW340.43 g/mol
LogP2.06
Rot. Bonds5

About 6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide

6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide (PubChem CID 39898275) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide
PubChem CID39898275
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide
SMILESC[C@@H]1CN(c2ccc(C(=O)NCCc3ccccn3)cn2)C[C@@H](C)O1
InChIInChI=1S/C19H24N4O2/c1-14-12-23(13-15(2)25-14)18-7-6-16(11-22-18)19(24)21-10-8-17-5-3-4-9-20-17/h3-7,9,11,14-15H,8,10,12-13H2,1-2H3,(H,21,24)/t14-,15-/m1/s1
InChIKeyHKZJQONRZOMROU-HUUCEWRRSA-N
XLogP2.06
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide?
The IUPAC name of 6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide (CID 39898275) is 6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide?
The canonical SMILES for 6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide is C[C@@H]1CN(c2ccc(C(=O)NCCc3ccccn3)cn2)C[C@@H](C)O1.
What is the InChIKey of 6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide?
The InChIKey is HKZJQONRZOMROU-HUUCEWRRSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-14-12-23(13-15(2)25-14)18-7-6-16(11-22-18)19(24)21-10-8-17-5-3-4-9-20-17/h3-7,9,11,14-15H,8,10,12-13H2,1-2H3,(H,21,24)/t14-,15-/m1/s1.
What are the key properties of 6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide?
6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 2.06, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide is sourced from PubChem (CID 39898275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).