N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide

C12H17N3O2 — CID 977791

IUPACN-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
SMILESO=C(NCCN1CCOCC1)c1ccccn1
InChIInChI=1S/C12H17N3O2/c16-12(11-3-1-2-4-13-11)14-5-6-15-7-9-17-10-8-15/h1-4H,5-10H2,(H,14,16)
InChIKeyHIFJEDVYEQQUNE-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.14
Rot. Bonds4

About N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide

N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide (PubChem CID 977791) has the molecular formula C12H17N3O2 and a molecular weight of 235.29 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
PubChem CID977791
Molecular FormulaC12H17N3O2
Molecular Weight235.29 g/mol
Exact Mass235.13
IUPAC NameN-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
SMILESO=C(NCCN1CCOCC1)c1ccccn1
InChIInChI=1S/C12H17N3O2/c16-12(11-3-1-2-4-13-11)14-5-6-15-7-9-17-10-8-15/h1-4H,5-10H2,(H,14,16)
InChIKeyHIFJEDVYEQQUNE-UHFFFAOYSA-N
XLogP0.14
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-morpholin-4-ylethyl)pyridine-2-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-(2-morpholin-4-ylethyl)pyridine-2-carboxamide?
The IUPAC name of N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide (CID 977791) is N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide?
The canonical SMILES for N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide is O=C(NCCN1CCOCC1)c1ccccn1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide?
The InChIKey is HIFJEDVYEQQUNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2/c16-12(11-3-1-2-4-13-11)14-5-6-15-7-9-17-10-8-15/h1-4H,5-10H2,(H,14,16).
What are the key properties of N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide?
N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide has a molecular weight of 235.29 g/mol, XLogP of 0.14, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide is sourced from PubChem (CID 977791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).