N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-oxo-1H-pyridine-3-carboxamide

C16H19N3O3S — CID 94180353

IUPACN-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-oxo-1H-pyridine-3-carboxamide
SMILESO=C(NC[C@H](c1cccs1)N1CCOCC1)c1ccc[nH]c1=O
InChIInChI=1S/C16H19N3O3S/c20-15-12(3-1-5-17-15)16(21)18-11-13(14-4-2-10-23-14)19-6-8-22-9-7-19/h1-5,10,13H,6-9,11H2,(H,17,20)(H,18,21)/t13-/m1/s1
InChIKeySMEVBFXBQHJCAW-CYBMUJFWSA-N
MW333.41 g/mol
LogP1.24
Rot. Bonds5

About N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-oxo-1H-pyridine-3-carboxamide

N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 94180353) has the molecular formula C16H19N3O3S and a molecular weight of 333.41 g/mol. Its IUPAC name is N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-oxo-1H-pyridine-3-carboxamide
PubChem CID94180353
Molecular FormulaC16H19N3O3S
Molecular Weight333.41 g/mol
Exact Mass333.11
IUPAC NameN-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-oxo-1H-pyridine-3-carboxamide
SMILESO=C(NC[C@H](c1cccs1)N1CCOCC1)c1ccc[nH]c1=O
InChIInChI=1S/C16H19N3O3S/c20-15-12(3-1-5-17-15)16(21)18-11-13(14-4-2-10-23-14)19-6-8-22-9-7-19/h1-5,10,13H,6-9,11H2,(H,17,20)(H,18,21)/t13-/m1/s1
InChIKeySMEVBFXBQHJCAW-CYBMUJFWSA-N
XLogP1.24
TPSA74.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.41
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-oxo-1H-pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-oxo-1H-pyridine-3-carboxamide (CID 94180353) is N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-oxo-1H-pyridine-3-carboxamide is O=C(NC[C@H](c1cccs1)N1CCOCC1)c1ccc[nH]c1=O.
What is the InChIKey of N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is SMEVBFXBQHJCAW-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H19N3O3S/c20-15-12(3-1-5-17-15)16(21)18-11-13(14-4-2-10-23-14)19-6-8-22-9-7-19/h1-5,10,13H,6-9,11H2,(H,17,20)(H,18,21)/t13-/m1/s1.
What are the key properties of N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-oxo-1H-pyridine-3-carboxamide?
N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 333.41 g/mol, XLogP of 1.24, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 94180353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).