5-(2-morpholin-4-ylethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide

C17H26N4O3 — CID 109184925

IUPAC5-(2-morpholin-4-ylethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
SMILESO=C(NCC1CCCO1)c1ccc(NCCN2CCOCC2)cn1
InChIInChI=1S/C17H26N4O3/c22-17(20-13-15-2-1-9-24-15)16-4-3-14(12-19-16)18-5-6-21-7-10-23-11-8-21/h3-4,12,15,18H,1-2,5-11,13H2,(H,20,22)
InChIKeyOEEDTZDLJYSOAB-UHFFFAOYSA-N
MW334.42 g/mol
LogP0.73
Rot. Bonds7

About 5-(2-morpholin-4-ylethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide

5-(2-morpholin-4-ylethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide (PubChem CID 109184925) has the molecular formula C17H26N4O3 and a molecular weight of 334.42 g/mol. Its IUPAC name is 5-(2-morpholin-4-ylethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(2-morpholin-4-ylethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
PubChem CID109184925
Molecular FormulaC17H26N4O3
Molecular Weight334.42 g/mol
Exact Mass334.20
IUPAC Name5-(2-morpholin-4-ylethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
SMILESO=C(NCC1CCCO1)c1ccc(NCCN2CCOCC2)cn1
InChIInChI=1S/C17H26N4O3/c22-17(20-13-15-2-1-9-24-15)16-4-3-14(12-19-16)18-5-6-21-7-10-23-11-8-21/h3-4,12,15,18H,1-2,5-11,13H2,(H,20,22)
InChIKeyOEEDTZDLJYSOAB-UHFFFAOYSA-N
XLogP0.73
TPSA75.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(2-morpholin-4-ylethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide?
The IUPAC name of 5-(2-morpholin-4-ylethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide (CID 109184925) is 5-(2-morpholin-4-ylethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(2-morpholin-4-ylethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(2-morpholin-4-ylethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide is O=C(NCC1CCCO1)c1ccc(NCCN2CCOCC2)cn1.
What is the InChIKey of 5-(2-morpholin-4-ylethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide?
The InChIKey is OEEDTZDLJYSOAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O3/c22-17(20-13-15-2-1-9-24-15)16-4-3-14(12-19-16)18-5-6-21-7-10-23-11-8-21/h3-4,12,15,18H,1-2,5-11,13H2,(H,20,22).
What are the key properties of 5-(2-morpholin-4-ylethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide?
5-(2-morpholin-4-ylethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide has a molecular weight of 334.42 g/mol, XLogP of 0.73, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-morpholin-4-ylethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide is sourced from PubChem (CID 109184925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).