3-morpholin-4-yl-3-oxo-N-(pyridin-3-ylmethyl)propanamide

C13H17N3O3 — CID 108943446

IUPAC3-morpholin-4-yl-3-oxo-N-(pyridin-3-ylmethyl)propanamide
SMILESO=C(CC(=O)N1CCOCC1)NCc1cccnc1
InChIInChI=1S/C13H17N3O3/c17-12(15-10-11-2-1-3-14-9-11)8-13(18)16-4-6-19-7-5-16/h1-3,9H,4-8,10H2,(H,15,17)
InChIKeyAZFKLWXXXNGZQE-UHFFFAOYSA-N
MW263.30 g/mol
LogP-0.05
Rot. Bonds4

About 3-morpholin-4-yl-3-oxo-N-(pyridin-3-ylmethyl)propanamide

3-morpholin-4-yl-3-oxo-N-(pyridin-3-ylmethyl)propanamide (PubChem CID 108943446) has the molecular formula C13H17N3O3 and a molecular weight of 263.30 g/mol. Its IUPAC name is 3-morpholin-4-yl-3-oxo-N-(pyridin-3-ylmethyl)propanamide.

Molecular Properties

Compound Name3-morpholin-4-yl-3-oxo-N-(pyridin-3-ylmethyl)propanamide
PubChem CID108943446
Molecular FormulaC13H17N3O3
Molecular Weight263.30 g/mol
Exact Mass263.13
IUPAC Name3-morpholin-4-yl-3-oxo-N-(pyridin-3-ylmethyl)propanamide
SMILESO=C(CC(=O)N1CCOCC1)NCc1cccnc1
InChIInChI=1S/C13H17N3O3/c17-12(15-10-11-2-1-3-14-9-11)8-13(18)16-4-6-19-7-5-16/h1-3,9H,4-8,10H2,(H,15,17)
InChIKeyAZFKLWXXXNGZQE-UHFFFAOYSA-N
XLogP-0.05
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

3-oxo-N-(pyridin-3-ylmethyl)-3-pyrrolidin-1-ylpropanamide
CID 108941959
2-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)acetamide
CID 108994762
2-[1-(2-morpholin-4-yl-2-oxoethyl)indol-3-yl]-2-oxo-N-(pyridin-3-ylmethyl)acetamide
CID 4277938
3-[4-(3-methylphenyl)piperazin-1-yl]-3-oxo-N-(pyridin-3-ylmethyl)propanamide
CID 108947620
N-[(3-methylphenyl)methyl]-3-morpholin-4-yl-3-oxopropanamide
CID 108943433
N-[(4-methylphenyl)methyl]-3-morpholin-4-yl-3-oxopropanamide
CID 108943434
N-(2-pyridin-3-ylethyl)morpholine-4-carboxamide
CID 110872249
1-(3-morpholin-4-ylpropyl)-3-(pyridin-3-ylmethyl)urea
CID 127566290
1-morpholin-4-yl-3-[4-(pyridin-3-ylmethyl)piperazin-1-yl]propan-1-one
CID 84592394
N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]-2-pyridin-3-ylacetamide
CID 131931518
4-[4-(3-chlorophenyl)piperazin-1-yl]-4-oxo-N-(pyridin-3-ylmethyl)butanamide
CID 71704556
5-morpholin-4-yl-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 109184765

Frequently Asked Questions

What is the IUPAC name of 3-morpholin-4-yl-3-oxo-N-(pyridin-3-ylmethyl)propanamide?
The IUPAC name of 3-morpholin-4-yl-3-oxo-N-(pyridin-3-ylmethyl)propanamide (CID 108943446) is 3-morpholin-4-yl-3-oxo-N-(pyridin-3-ylmethyl)propanamide.
What is the SMILES notation for 3-morpholin-4-yl-3-oxo-N-(pyridin-3-ylmethyl)propanamide?
The canonical SMILES for 3-morpholin-4-yl-3-oxo-N-(pyridin-3-ylmethyl)propanamide is O=C(CC(=O)N1CCOCC1)NCc1cccnc1.
What is the InChIKey of 3-morpholin-4-yl-3-oxo-N-(pyridin-3-ylmethyl)propanamide?
The InChIKey is AZFKLWXXXNGZQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O3/c17-12(15-10-11-2-1-3-14-9-11)8-13(18)16-4-6-19-7-5-16/h1-3,9H,4-8,10H2,(H,15,17).
What are the key properties of 3-morpholin-4-yl-3-oxo-N-(pyridin-3-ylmethyl)propanamide?
3-morpholin-4-yl-3-oxo-N-(pyridin-3-ylmethyl)propanamide has a molecular weight of 263.30 g/mol, XLogP of -0.05, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-morpholin-4-yl-3-oxo-N-(pyridin-3-ylmethyl)propanamide is sourced from PubChem (CID 108943446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).