4-[2-(2-oxo-1-pyridinyl)ethylamino]butanamide

C11H17N3O2 — CID 82897026

IUPAC4-[2-(2-oxo-1-pyridinyl)ethylamino]butanamide
SMILESNC(=O)CCCNCCn1ccccc1=O
InChIInChI=1S/C11H17N3O2/c12-10(15)4-3-6-13-7-9-14-8-2-1-5-11(14)16/h1-2,5,8,13H,3-4,6-7,9H2,(H2,12,15)
InChIKeyPWUYIYSSSQAJQA-UHFFFAOYSA-N
MW223.28 g/mol
LogP-0.30
Rot. Bonds7

About 4-[2-(2-oxo-1-pyridinyl)ethylamino]butanamide

4-[2-(2-oxo-1-pyridinyl)ethylamino]butanamide (PubChem CID 82897026) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 4-[2-(2-oxo-1-pyridinyl)ethylamino]butanamide.

Molecular Properties

Compound Name4-[2-(2-oxo-1-pyridinyl)ethylamino]butanamide
PubChem CID82897026
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name4-[2-(2-oxo-1-pyridinyl)ethylamino]butanamide
SMILESNC(=O)CCCNCCn1ccccc1=O
InChIInChI=1S/C11H17N3O2/c12-10(15)4-3-6-13-7-9-14-8-2-1-5-11(14)16/h1-2,5,8,13H,3-4,6-7,9H2,(H2,12,15)
InChIKeyPWUYIYSSSQAJQA-UHFFFAOYSA-N
XLogP-0.30
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-[2-(3-bromopropylamino)ethyl]pyridin-2-one
CID 82907735
N-methyl-3-[2-(2-oxo-1-pyridinyl)ethylamino]propanamide
CID 82897118
ethyl 3-[2-(2-oxo-1-pyridinyl)ethylamino]propanoate
CID 82897754
1-[2-[3-(dimethylamino)propylamino]ethyl]pyridin-2-one
CID 62564162
2-[2-(2-oxo-1-pyridinyl)ethylamino]oxyacetamide
CID 112673701
1-[2-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]ethyl]pyridin-2-one
CID 112689214
3-[2-(2-oxo-1-pyridinyl)ethylamino]butanamide
CID 115676590
1-[2-(benzylamino)ethyl]pyridin-2-one
CID 55070999
3-(2-oxo-1-pyridinyl)propanehydrazide
CID 43346089
4-[2-(2-oxo-1-pyridinyl)ethylamino]benzamide
CID 82897188
N-(2-aminoethyl)-4-(2-oxo-1-pyridinyl)butanamide
CID 82031758
N-benzyl-2-[2-(2-oxo-1-pyridinyl)ethylamino]acetamide
CID 82898701

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-oxo-1-pyridinyl)ethylamino]butanamide?
The IUPAC name of 4-[2-(2-oxo-1-pyridinyl)ethylamino]butanamide (CID 82897026) is 4-[2-(2-oxo-1-pyridinyl)ethylamino]butanamide.
What is the SMILES notation for 4-[2-(2-oxo-1-pyridinyl)ethylamino]butanamide?
The canonical SMILES for 4-[2-(2-oxo-1-pyridinyl)ethylamino]butanamide is NC(=O)CCCNCCn1ccccc1=O.
What is the InChIKey of 4-[2-(2-oxo-1-pyridinyl)ethylamino]butanamide?
The InChIKey is PWUYIYSSSQAJQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c12-10(15)4-3-6-13-7-9-14-8-2-1-5-11(14)16/h1-2,5,8,13H,3-4,6-7,9H2,(H2,12,15).
What are the key properties of 4-[2-(2-oxo-1-pyridinyl)ethylamino]butanamide?
4-[2-(2-oxo-1-pyridinyl)ethylamino]butanamide has a molecular weight of 223.28 g/mol, XLogP of -0.30, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-oxo-1-pyridinyl)ethylamino]butanamide is sourced from PubChem (CID 82897026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).