ethyl 3-[(3R)-1-methylpiperidin-3-yl]propanoate

C11H21NO2 — CID 59958651

IUPACethyl 3-[(3R)-1-methylpiperidin-3-yl]propanoate
SMILESCCOC(=O)CC[C@H]1CCCN(C)C1
InChIInChI=1S/C11H21NO2/c1-3-14-11(13)7-6-10-5-4-8-12(2)9-10/h10H,3-9H2,1-2H3/t10-/m1/s1
InChIKeyFYOZARDNATXIJA-SNVBAGLBSA-N
MW199.29 g/mol
LogP1.67
Rot. Bonds4

About ethyl 3-[(3R)-1-methylpiperidin-3-yl]propanoate

ethyl 3-[(3R)-1-methylpiperidin-3-yl]propanoate (PubChem CID 59958651) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is ethyl 3-[(3R)-1-methylpiperidin-3-yl]propanoate.

Molecular Properties

Compound Nameethyl 3-[(3R)-1-methylpiperidin-3-yl]propanoate
PubChem CID59958651
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Nameethyl 3-[(3R)-1-methylpiperidin-3-yl]propanoate
SMILESCCOC(=O)CC[C@H]1CCCN(C)C1
InChIInChI=1S/C11H21NO2/c1-3-14-11(13)7-6-10-5-4-8-12(2)9-10/h10H,3-9H2,1-2H3/t10-/m1/s1
InChIKeyFYOZARDNATXIJA-SNVBAGLBSA-N
XLogP1.67
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze ethyl 3-[(3R)-1-methylpiperidin-3-yl]propanoate 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

ethyl 2-[3-(3-ethoxy-3-oxopropyl)piperidin-1-yl]propanoate
CID 70373350
N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide
CID 116845050
ethyl 3-[5-(cyclobutylmethylamino)-1-methylpiperidin-3-yl]propanoate
CID 83996913
ethyl 3-[(3S)-1-(1-methylpyrrole-2-carbonyl)piperidin-3-yl]propanoate
CID 97240405
ethyl 2-[2-(1-methylpiperidin-3-yl)ethylamino]-2-oxoacetate
CID 115142076
ethyl 3-[methyl-(1-methylpiperidin-3-yl)amino]propanoate
CID 62546082
ethyl (3R)-1-methylpiperidine-3-carboxylate
CID 736036
ethyl 3-(1-propylpiperidin-4-yl)propanoate
CID 125041797
ethyl 3-[1-methyl-5-(methylamino)piperidin-3-yl]propanoate
CID 83989535
ethyl 5-(3-aminopiperidin-1-yl)-4-oxopentanoate
CID 103484354
ethyl 4-[3-(hydroxymethyl)piperidin-1-yl]-4-oxobutanoate
CID 43422393
ethyl 2-[3-(2-hydroxyethyl)piperidin-1-yl]acetate
CID 62356988

Frequently Asked Questions

What is the IUPAC name of ethyl 3-[(3R)-1-methylpiperidin-3-yl]propanoate?
The IUPAC name of ethyl 3-[(3R)-1-methylpiperidin-3-yl]propanoate (CID 59958651) is ethyl 3-[(3R)-1-methylpiperidin-3-yl]propanoate.
What is the SMILES notation for ethyl 3-[(3R)-1-methylpiperidin-3-yl]propanoate?
The canonical SMILES for ethyl 3-[(3R)-1-methylpiperidin-3-yl]propanoate is CCOC(=O)CC[C@H]1CCCN(C)C1.
What is the InChIKey of ethyl 3-[(3R)-1-methylpiperidin-3-yl]propanoate?
The InChIKey is FYOZARDNATXIJA-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H21NO2/c1-3-14-11(13)7-6-10-5-4-8-12(2)9-10/h10H,3-9H2,1-2H3/t10-/m1/s1.
What are the key properties of ethyl 3-[(3R)-1-methylpiperidin-3-yl]propanoate?
ethyl 3-[(3R)-1-methylpiperidin-3-yl]propanoate has a molecular weight of 199.29 g/mol, XLogP of 1.67, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 3-[(3R)-1-methylpiperidin-3-yl]propanoate is sourced from PubChem (CID 59958651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).