N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]pyridine-4-carboxamide

C17H20N4O3 — CID 84559427

IUPACN-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]pyridine-4-carboxamide
SMILESO=C(Nc1ccc(OCCN2CCOCC2)nc1)c1ccncc1
InChIInChI=1S/C17H20N4O3/c22-17(14-3-5-18-6-4-14)20-15-1-2-16(19-13-15)24-12-9-21-7-10-23-11-8-21/h1-6,13H,7-12H2,(H,20,22)
InChIKeyWPKAKCVHNYFOLQ-UHFFFAOYSA-N
MW328.37 g/mol
LogP1.44
Rot. Bonds6

About N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]pyridine-4-carboxamide

N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]pyridine-4-carboxamide (PubChem CID 84559427) has the molecular formula C17H20N4O3 and a molecular weight of 328.37 g/mol. Its IUPAC name is N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]pyridine-4-carboxamide
PubChem CID84559427
Molecular FormulaC17H20N4O3
Molecular Weight328.37 g/mol
Exact Mass328.15
IUPAC NameN-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]pyridine-4-carboxamide
SMILESO=C(Nc1ccc(OCCN2CCOCC2)nc1)c1ccncc1
InChIInChI=1S/C17H20N4O3/c22-17(14-3-5-18-6-4-14)20-15-1-2-16(19-13-15)24-12-9-21-7-10-23-11-8-21/h1-6,13H,7-12H2,(H,20,22)
InChIKeyWPKAKCVHNYFOLQ-UHFFFAOYSA-N
XLogP1.44
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]pyridine-4-carboxamide?
The IUPAC name of N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]pyridine-4-carboxamide (CID 84559427) is N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]pyridine-4-carboxamide.
What is the SMILES notation for N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]pyridine-4-carboxamide?
The canonical SMILES for N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]pyridine-4-carboxamide is O=C(Nc1ccc(OCCN2CCOCC2)nc1)c1ccncc1.
What is the InChIKey of N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]pyridine-4-carboxamide?
The InChIKey is WPKAKCVHNYFOLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O3/c22-17(14-3-5-18-6-4-14)20-15-1-2-16(19-13-15)24-12-9-21-7-10-23-11-8-21/h1-6,13H,7-12H2,(H,20,22).
What are the key properties of N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]pyridine-4-carboxamide?
N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]pyridine-4-carboxamide has a molecular weight of 328.37 g/mol, XLogP of 1.44, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]pyridine-4-carboxamide is sourced from PubChem (CID 84559427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).