2-(dimethylamino)-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide

C18H22N4O2 — CID 110299292

IUPAC2-(dimethylamino)-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide
SMILESCN(C)c1ncccc1C(=O)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C18H22N4O2/c1-21(2)17-14(6-5-9-19-17)18(23)20-15-7-3-4-8-16(15)22-10-12-24-13-11-22/h3-9H,10-13H2,1-2H3,(H,20,23)
InChIKeyRFFDCGNWQHOHCM-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.24
Rot. Bonds4

About 2-(dimethylamino)-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide

2-(dimethylamino)-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide (PubChem CID 110299292) has the molecular formula C18H22N4O2 and a molecular weight of 326.40 g/mol. Its IUPAC name is 2-(dimethylamino)-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide
PubChem CID110299292
Molecular FormulaC18H22N4O2
Molecular Weight326.40 g/mol
Exact Mass326.17
IUPAC Name2-(dimethylamino)-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide
SMILESCN(C)c1ncccc1C(=O)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C18H22N4O2/c1-21(2)17-14(6-5-9-19-17)18(23)20-15-7-3-4-8-16(15)22-10-12-24-13-11-22/h3-9H,10-13H2,1-2H3,(H,20,23)
InChIKeyRFFDCGNWQHOHCM-UHFFFAOYSA-N
XLogP2.24
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide?
The IUPAC name of 2-(dimethylamino)-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide (CID 110299292) is 2-(dimethylamino)-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-(dimethylamino)-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 2-(dimethylamino)-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide is CN(C)c1ncccc1C(=O)Nc1ccccc1N1CCOCC1.
What is the InChIKey of 2-(dimethylamino)-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide?
The InChIKey is RFFDCGNWQHOHCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O2/c1-21(2)17-14(6-5-9-19-17)18(23)20-15-7-3-4-8-16(15)22-10-12-24-13-11-22/h3-9H,10-13H2,1-2H3,(H,20,23).
What are the key properties of 2-(dimethylamino)-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide?
2-(dimethylamino)-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide has a molecular weight of 326.40 g/mol, XLogP of 2.24, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 110299292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).