4-(3-pyridin-4-yloxypropyl)piperidine-1-carboxylic acid

C14H20N2O3 — CID 154254683

IUPAC4-(3-pyridin-4-yloxypropyl)piperidine-1-carboxylic acid
SMILESO=C(O)N1CCC(CCCOc2ccncc2)CC1
InChIInChI=1S/C14H20N2O3/c17-14(18)16-9-5-12(6-10-16)2-1-11-19-13-3-7-15-8-4-13/h3-4,7-8,12H,1-2,5-6,9-11H2,(H,17,18)
InChIKeyNUTDNCIHMJPPFF-UHFFFAOYSA-N
MW264.32 g/mol
LogP2.63
Rot. Bonds5

About 4-(3-pyridin-4-yloxypropyl)piperidine-1-carboxylic acid

4-(3-pyridin-4-yloxypropyl)piperidine-1-carboxylic acid (PubChem CID 154254683) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 4-(3-pyridin-4-yloxypropyl)piperidine-1-carboxylic acid.

Molecular Properties

Compound Name4-(3-pyridin-4-yloxypropyl)piperidine-1-carboxylic acid
PubChem CID154254683
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name4-(3-pyridin-4-yloxypropyl)piperidine-1-carboxylic acid
SMILESO=C(O)N1CCC(CCCOc2ccncc2)CC1
InChIInChI=1S/C14H20N2O3/c17-14(18)16-9-5-12(6-10-16)2-1-11-19-13-3-7-15-8-4-13/h3-4,7-8,12H,1-2,5-6,9-11H2,(H,17,18)
InChIKeyNUTDNCIHMJPPFF-UHFFFAOYSA-N
XLogP2.63
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4-(3-pyridin-4-yloxypropyl)piperidine-1-carboxylic acid 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

1-[4-(2-pyridin-4-yloxyethyl)piperidin-1-yl]butan-1-one
CID 53150958
N-benzyl-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide
CID 53150970
4-(2-cyclopropylethoxy)pyridine
CID 174949801
4-[3-(furo[3,2-c]pyridin-2-ylmethoxy)propyl]piperidine-1-carboxylic acid
CID 69325150
(2-ethylpyrazol-3-yl)-[4-(2-pyridin-4-yloxyethyl)piperidin-1-yl]methanone
CID 53150962
4-[4-[4-[3-(4-cyanophenoxy)propyl]-2,3-dioxopiperazin-1-yl]butyl]piperidine-1-carboxylic acid
CID 151567347
1-[4-(2-phenoxyethyl)piperidin-1-yl]ethanone
CID 53150715
[4-(2-phenoxyethyl)piperidin-1-yl]-pyrazin-2-ylmethanone
CID 53150710
4-(3-phenylpropyl)piperidine-1-carboxylic acid
CID 67759674
N-(2-methoxyphenyl)-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide
CID 53150975
4-(2-cyclopentylethoxy)pyridine
CID 91320777
4-(4-pyridin-4-yloxycyclohexyl)oxypiperidine-1-carboxylic acid
CID 123525099

Frequently Asked Questions

What is the IUPAC name of 4-(3-pyridin-4-yloxypropyl)piperidine-1-carboxylic acid?
The IUPAC name of 4-(3-pyridin-4-yloxypropyl)piperidine-1-carboxylic acid (CID 154254683) is 4-(3-pyridin-4-yloxypropyl)piperidine-1-carboxylic acid.
What is the SMILES notation for 4-(3-pyridin-4-yloxypropyl)piperidine-1-carboxylic acid?
The canonical SMILES for 4-(3-pyridin-4-yloxypropyl)piperidine-1-carboxylic acid is O=C(O)N1CCC(CCCOc2ccncc2)CC1.
What is the InChIKey of 4-(3-pyridin-4-yloxypropyl)piperidine-1-carboxylic acid?
The InChIKey is NUTDNCIHMJPPFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c17-14(18)16-9-5-12(6-10-16)2-1-11-19-13-3-7-15-8-4-13/h3-4,7-8,12H,1-2,5-6,9-11H2,(H,17,18).
What are the key properties of 4-(3-pyridin-4-yloxypropyl)piperidine-1-carboxylic acid?
4-(3-pyridin-4-yloxypropyl)piperidine-1-carboxylic acid has a molecular weight of 264.32 g/mol, XLogP of 2.63, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-pyridin-4-yloxypropyl)piperidine-1-carboxylic acid is sourced from PubChem (CID 154254683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).