3-(4-ethoxypiperidin-1-yl)-1-(5-fluoro-2-pyridinyl)propan-1-amine

C15H24FN3O — CID 83126355

IUPAC3-(4-ethoxypiperidin-1-yl)-1-(5-fluoro-2-pyridinyl)propan-1-amine
SMILESCCOC1CCN(CCC(N)c2ccc(F)cn2)CC1
InChIInChI=1S/C15H24FN3O/c1-2-20-13-5-8-19(9-6-13)10-7-14(17)15-4-3-12(16)11-18-15/h3-4,11,13-14H,2,5-10,17H2,1H3
InChIKeyVHFXMTONLWCXCR-UHFFFAOYSA-N
MW281.37 g/mol
LogP2.11
Rot. Bonds6

About 3-(4-ethoxypiperidin-1-yl)-1-(5-fluoro-2-pyridinyl)propan-1-amine

3-(4-ethoxypiperidin-1-yl)-1-(5-fluoro-2-pyridinyl)propan-1-amine (PubChem CID 83126355) has the molecular formula C15H24FN3O and a molecular weight of 281.37 g/mol. Its IUPAC name is 3-(4-ethoxypiperidin-1-yl)-1-(5-fluoro-2-pyridinyl)propan-1-amine.

Molecular Properties

Compound Name3-(4-ethoxypiperidin-1-yl)-1-(5-fluoro-2-pyridinyl)propan-1-amine
PubChem CID83126355
Molecular FormulaC15H24FN3O
Molecular Weight281.37 g/mol
Exact Mass281.19
IUPAC Name3-(4-ethoxypiperidin-1-yl)-1-(5-fluoro-2-pyridinyl)propan-1-amine
SMILESCCOC1CCN(CCC(N)c2ccc(F)cn2)CC1
InChIInChI=1S/C15H24FN3O/c1-2-20-13-5-8-19(9-6-13)10-7-14(17)15-4-3-12(16)11-18-15/h3-4,11,13-14H,2,5-10,17H2,1H3
InChIKeyVHFXMTONLWCXCR-UHFFFAOYSA-N
XLogP2.11
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.37
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(4-ethoxypiperidin-1-yl)-1-(5-fluoro-2-pyridinyl)propan-1-amine with MolForge

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

Launch Full Analysis

Related Compounds

CID 566605
CID 566605
CID 95909
CID 95909
CID 269694
CID 269694
CID 4988991
CID 4988991
CID 437973
CID 437973
CID 25177630
CID 25177630
CID 22767593
CID 22767593
CID 155523419
CID 155523419
CID 155540433
CID 155540433
CID 135374672
CID 135374672
CID 135374676
CID 135374676
CID 135374711
CID 135374711

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethoxypiperidin-1-yl)-1-(5-fluoro-2-pyridinyl)propan-1-amine?
The IUPAC name of 3-(4-ethoxypiperidin-1-yl)-1-(5-fluoro-2-pyridinyl)propan-1-amine (CID 83126355) is 3-(4-ethoxypiperidin-1-yl)-1-(5-fluoro-2-pyridinyl)propan-1-amine.
What is the SMILES notation for 3-(4-ethoxypiperidin-1-yl)-1-(5-fluoro-2-pyridinyl)propan-1-amine?
The canonical SMILES for 3-(4-ethoxypiperidin-1-yl)-1-(5-fluoro-2-pyridinyl)propan-1-amine is CCOC1CCN(CCC(N)c2ccc(F)cn2)CC1.
What is the InChIKey of 3-(4-ethoxypiperidin-1-yl)-1-(5-fluoro-2-pyridinyl)propan-1-amine?
The InChIKey is VHFXMTONLWCXCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24FN3O/c1-2-20-13-5-8-19(9-6-13)10-7-14(17)15-4-3-12(16)11-18-15/h3-4,11,13-14H,2,5-10,17H2,1H3.
What are the key properties of 3-(4-ethoxypiperidin-1-yl)-1-(5-fluoro-2-pyridinyl)propan-1-amine?
3-(4-ethoxypiperidin-1-yl)-1-(5-fluoro-2-pyridinyl)propan-1-amine has a molecular weight of 281.37 g/mol, XLogP of 2.11, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethoxypiperidin-1-yl)-1-(5-fluoro-2-pyridinyl)propan-1-amine is sourced from PubChem (CID 83126355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).