piperidin-4-ylmethyl furan-2-carboxylate

C11H15NO3 — CID 53410145

IUPACpiperidin-4-ylmethyl furan-2-carboxylate
SMILESO=C(OCC1CCNCC1)c1ccco1
InChIInChI=1S/C11H15NO3/c13-11(10-2-1-7-14-10)15-8-9-3-5-12-6-4-9/h1-2,7,9,12H,3-6,8H2
InChIKeyXQIROVCHMFWIJT-UHFFFAOYSA-N
MW209.24 g/mol
LogP1.44
Rot. Bonds3

About piperidin-4-ylmethyl furan-2-carboxylate

piperidin-4-ylmethyl furan-2-carboxylate (PubChem CID 53410145) has the molecular formula C11H15NO3 and a molecular weight of 209.24 g/mol. Its IUPAC name is piperidin-4-ylmethyl furan-2-carboxylate.

Molecular Properties

Compound Namepiperidin-4-ylmethyl furan-2-carboxylate
PubChem CID53410145
Molecular FormulaC11H15NO3
Molecular Weight209.24 g/mol
Exact Mass209.11
IUPAC Namepiperidin-4-ylmethyl furan-2-carboxylate
SMILESO=C(OCC1CCNCC1)c1ccco1
InChIInChI=1S/C11H15NO3/c13-11(10-2-1-7-14-10)15-8-9-3-5-12-6-4-9/h1-2,7,9,12H,3-6,8H2
InChIKeyXQIROVCHMFWIJT-UHFFFAOYSA-N
XLogP1.44
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.24
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze piperidin-4-ylmethyl furan-2-carboxylate 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

oxolan-2-ylmethyl furan-2-carboxylate
CID 551325
[(1R,3R)-2,2-dichloro-3-(furan-2-carbonyloxymethyl)cyclopropyl]methyl furan-2-carboxylate
CID 1183207
N-ethyl-N-(piperidin-4-ylmethyl)furan-2-carboxamide
CID 79720984
bromomethyl furan-2-carboxylate
CID 54363056
[(2R)-5,5-dimethyloxolan-2-yl]methyl furan-2-carboxylate
CID 99795689
piperidin-4-ylmethyl pyridine-4-carboxylate;hydrochloride
CID 53410155
piperidin-4-ylmethyl naphthalene-1-carboxylate;hydrochloride
CID 68534065
1-(furan-2-yl)-2-[[(3S)-pyrrolidin-3-yl]methylamino]ethanone
CID 97165702
N-[4-[(2-piperidin-4-ylacetyl)amino]phenyl]furan-2-carboxamide;hydrochloride
CID 119700778
2-(1-methylpyrrolidin-2-yl)ethyl furan-2-carboxylate
CID 23738695
N-(2-piperidin-4-yloxyethyl)furan-2-carboxamide
CID 55251726
cyclopentyl furan-2-carboxylate
CID 565207

Frequently Asked Questions

What is the IUPAC name of piperidin-4-ylmethyl furan-2-carboxylate?
The IUPAC name of piperidin-4-ylmethyl furan-2-carboxylate (CID 53410145) is piperidin-4-ylmethyl furan-2-carboxylate.
What is the SMILES notation for piperidin-4-ylmethyl furan-2-carboxylate?
The canonical SMILES for piperidin-4-ylmethyl furan-2-carboxylate is O=C(OCC1CCNCC1)c1ccco1.
What is the InChIKey of piperidin-4-ylmethyl furan-2-carboxylate?
The InChIKey is XQIROVCHMFWIJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO3/c13-11(10-2-1-7-14-10)15-8-9-3-5-12-6-4-9/h1-2,7,9,12H,3-6,8H2.
What are the key properties of piperidin-4-ylmethyl furan-2-carboxylate?
piperidin-4-ylmethyl furan-2-carboxylate has a molecular weight of 209.24 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-4-ylmethyl furan-2-carboxylate is sourced from PubChem (CID 53410145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).