4-methoxy-N-(2-piperidin-1-yl-3-pyridinyl)butanamide

C15H23N3O2 — CID 47068338

IUPAC4-methoxy-N-(2-piperidin-1-yl-3-pyridinyl)butanamide
SMILESCOCCCC(=O)Nc1cccnc1N1CCCCC1
InChIInChI=1S/C15H23N3O2/c1-20-12-6-8-14(19)17-13-7-5-9-16-15(13)18-10-3-2-4-11-18/h5,7,9H,2-4,6,8,10-12H2,1H3,(H,17,19)
InChIKeyIRVASPGKMYPYMR-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.44
Rot. Bonds6

About 4-methoxy-N-(2-piperidin-1-yl-3-pyridinyl)butanamide

4-methoxy-N-(2-piperidin-1-yl-3-pyridinyl)butanamide (PubChem CID 47068338) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 4-methoxy-N-(2-piperidin-1-yl-3-pyridinyl)butanamide.

Molecular Properties

Compound Name4-methoxy-N-(2-piperidin-1-yl-3-pyridinyl)butanamide
PubChem CID47068338
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name4-methoxy-N-(2-piperidin-1-yl-3-pyridinyl)butanamide
SMILESCOCCCC(=O)Nc1cccnc1N1CCCCC1
InChIInChI=1S/C15H23N3O2/c1-20-12-6-8-14(19)17-13-7-5-9-16-15(13)18-10-3-2-4-11-18/h5,7,9H,2-4,6,8,10-12H2,1H3,(H,17,19)
InChIKeyIRVASPGKMYPYMR-UHFFFAOYSA-N
XLogP2.44
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-methoxy-N-(2-piperidin-1-yl-3-pyridinyl)butanamide 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 4-methoxy-N-(2-piperidin-1-yl-3-pyridinyl)butanamide?
The IUPAC name of 4-methoxy-N-(2-piperidin-1-yl-3-pyridinyl)butanamide (CID 47068338) is 4-methoxy-N-(2-piperidin-1-yl-3-pyridinyl)butanamide.
What is the SMILES notation for 4-methoxy-N-(2-piperidin-1-yl-3-pyridinyl)butanamide?
The canonical SMILES for 4-methoxy-N-(2-piperidin-1-yl-3-pyridinyl)butanamide is COCCCC(=O)Nc1cccnc1N1CCCCC1.
What is the InChIKey of 4-methoxy-N-(2-piperidin-1-yl-3-pyridinyl)butanamide?
The InChIKey is IRVASPGKMYPYMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-20-12-6-8-14(19)17-13-7-5-9-16-15(13)18-10-3-2-4-11-18/h5,7,9H,2-4,6,8,10-12H2,1H3,(H,17,19).
What are the key properties of 4-methoxy-N-(2-piperidin-1-yl-3-pyridinyl)butanamide?
4-methoxy-N-(2-piperidin-1-yl-3-pyridinyl)butanamide has a molecular weight of 277.37 g/mol, XLogP of 2.44, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(2-piperidin-1-yl-3-pyridinyl)butanamide is sourced from PubChem (CID 47068338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).