3-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]oxypropanoic acid

C14H24N2O4 — CID 104913988

IUPAC3-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]oxypropanoic acid
SMILESO=C(O)CCOC1CCN(C(=O)[C@H]2CCCCN2)CC1
InChIInChI=1S/C14H24N2O4/c17-13(18)6-10-20-11-4-8-16(9-5-11)14(19)12-3-1-2-7-15-12/h11-12,15H,1-10H2,(H,17,18)/t12-/m1/s1
InChIKeyAHXAITHUEYQXQH-GFCCVEGCSA-N
MW284.36 g/mol
LogP0.61
Rot. Bonds5

About 3-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]oxypropanoic acid

3-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]oxypropanoic acid (PubChem CID 104913988) has the molecular formula C14H24N2O4 and a molecular weight of 284.36 g/mol. Its IUPAC name is 3-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]oxypropanoic acid.

Molecular Properties

Compound Name3-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]oxypropanoic acid
PubChem CID104913988
Molecular FormulaC14H24N2O4
Molecular Weight284.36 g/mol
Exact Mass284.17
IUPAC Name3-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]oxypropanoic acid
SMILESO=C(O)CCOC1CCN(C(=O)[C@H]2CCCCN2)CC1
InChIInChI=1S/C14H24N2O4/c17-13(18)6-10-20-11-4-8-16(9-5-11)14(19)12-3-1-2-7-15-12/h11-12,15H,1-10H2,(H,17,18)/t12-/m1/s1
InChIKeyAHXAITHUEYQXQH-GFCCVEGCSA-N
XLogP0.61
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]oxypropanoic 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

(4-propoxyazepan-1-yl)-pyrrolidin-2-ylmethanone;hydrochloride
CID 119321499
3-[1-[(3R)-piperidine-3-carbonyl]piperidin-4-yl]oxypropanoic acid
CID 81140994
[3-(3-methylbutoxy)pyrrolidin-1-yl]-pyrrolidin-2-ylmethanone;hydrochloride
CID 119149844
[4-(oxan-2-ylmethoxy)piperidin-1-yl]-piperidin-2-ylmethanone;hydrochloride
CID 119341852
(4-phenoxypiperidin-1-yl)-piperidin-2-ylmethanone
CID 60859991
azepan-1-yl(azepan-2-yl)methanone
CID 64562203
azepan-1-yl-[(2R)-piperidin-2-yl]methanone
CID 7183049
3-cyclopentyloxypropanoic acid
CID 24706641
(4-aminopiperidin-1-yl)-[(2S)-piperidin-2-yl]methanone
CID 154266528
3-[1-[(2S)-oxolane-2-carbonyl]piperidin-4-yl]oxypropanoic acid
CID 104855710
[3-(2-methylpropoxy)pyrrolidin-1-yl]-piperidin-2-ylmethanone;hydrochloride
CID 119345316
azocan-1-yl-[(2S)-piperidin-2-yl]methanone;hydrochloride
CID 119676414

Frequently Asked Questions

What is the IUPAC name of 3-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]oxypropanoic acid?
The IUPAC name of 3-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]oxypropanoic acid (CID 104913988) is 3-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]oxypropanoic acid.
What is the SMILES notation for 3-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]oxypropanoic acid?
The canonical SMILES for 3-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]oxypropanoic acid is O=C(O)CCOC1CCN(C(=O)[C@H]2CCCCN2)CC1.
What is the InChIKey of 3-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]oxypropanoic acid?
The InChIKey is AHXAITHUEYQXQH-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H24N2O4/c17-13(18)6-10-20-11-4-8-16(9-5-11)14(19)12-3-1-2-7-15-12/h11-12,15H,1-10H2,(H,17,18)/t12-/m1/s1.
What are the key properties of 3-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]oxypropanoic acid?
3-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]oxypropanoic acid has a molecular weight of 284.36 g/mol, XLogP of 0.61, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-[(2R)-piperidine-2-carbonyl]piperidin-4-yl]oxypropanoic acid is sourced from PubChem (CID 104913988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).