N-[3-(morpholine-4-carbonyl)thiophen-2-yl]pyridine-3-carboxamide

C15H15N3O3S — CID 1247743

IUPACN-[3-(morpholine-4-carbonyl)thiophen-2-yl]pyridine-3-carboxamide
SMILESO=C(Nc1sccc1C(=O)N1CCOCC1)c1cccnc1
InChIInChI=1S/C15H15N3O3S/c19-13(11-2-1-4-16-10-11)17-14-12(3-9-22-14)15(20)18-5-7-21-8-6-18/h1-4,9-10H,5-8H2,(H,17,19)
InChIKeyBHZAFPWRWZHWSJ-UHFFFAOYSA-N
MW317.37 g/mol
LogP1.87
Rot. Bonds3

About N-[3-(morpholine-4-carbonyl)thiophen-2-yl]pyridine-3-carboxamide

N-[3-(morpholine-4-carbonyl)thiophen-2-yl]pyridine-3-carboxamide (PubChem CID 1247743) has the molecular formula C15H15N3O3S and a molecular weight of 317.37 g/mol. Its IUPAC name is N-[3-(morpholine-4-carbonyl)thiophen-2-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-(morpholine-4-carbonyl)thiophen-2-yl]pyridine-3-carboxamide
PubChem CID1247743
Molecular FormulaC15H15N3O3S
Molecular Weight317.37 g/mol
Exact Mass317.08
IUPAC NameN-[3-(morpholine-4-carbonyl)thiophen-2-yl]pyridine-3-carboxamide
SMILESO=C(Nc1sccc1C(=O)N1CCOCC1)c1cccnc1
InChIInChI=1S/C15H15N3O3S/c19-13(11-2-1-4-16-10-11)17-14-12(3-9-22-14)15(20)18-5-7-21-8-6-18/h1-4,9-10H,5-8H2,(H,17,19)
InChIKeyBHZAFPWRWZHWSJ-UHFFFAOYSA-N
XLogP1.87
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.37
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[3-(morpholine-4-carbonyl)thiophen-2-yl]pyridine-3-carboxamide?
The IUPAC name of N-[3-(morpholine-4-carbonyl)thiophen-2-yl]pyridine-3-carboxamide (CID 1247743) is N-[3-(morpholine-4-carbonyl)thiophen-2-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-[3-(morpholine-4-carbonyl)thiophen-2-yl]pyridine-3-carboxamide?
The canonical SMILES for N-[3-(morpholine-4-carbonyl)thiophen-2-yl]pyridine-3-carboxamide is O=C(Nc1sccc1C(=O)N1CCOCC1)c1cccnc1.
What is the InChIKey of N-[3-(morpholine-4-carbonyl)thiophen-2-yl]pyridine-3-carboxamide?
The InChIKey is BHZAFPWRWZHWSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3S/c19-13(11-2-1-4-16-10-11)17-14-12(3-9-22-14)15(20)18-5-7-21-8-6-18/h1-4,9-10H,5-8H2,(H,17,19).
What are the key properties of N-[3-(morpholine-4-carbonyl)thiophen-2-yl]pyridine-3-carboxamide?
N-[3-(morpholine-4-carbonyl)thiophen-2-yl]pyridine-3-carboxamide has a molecular weight of 317.37 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(morpholine-4-carbonyl)thiophen-2-yl]pyridine-3-carboxamide is sourced from PubChem (CID 1247743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).